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(1R,2S)-1-Amino-N-(cyclopropylsulfonyl)-2-vinylcyclopropanecarboxamide 4-methylbenzenesulfonate

(1R,2S)-1-Amino-N-(cyclopropylsulfonyl)-2-vinylcyclopropanecarboxamide 4-methylbenzenesulfonate - CAS 1028252-16-5

Catalog:	BB054894
Product Name:	(1R,2S)-1-Amino-N-(cyclopropylsulfonyl)-2-vinylcyclopropanecarboxamide 4-methylbenzenesulfonate
CAS:	1028252-16-5
Synonyms:	(1R,2S)-1-amino-N-(cyclopropylsulfonyl)-2-vinylcyclopropanecarboxamide 4-methylbenzenesulfonate; (1R,2S)-1-amino-N-cyclopropylsulfonyl-2-ethenylcyclopropane-1-carboxamide; 4-methylbenzenesulfonic acid; (1R,2S)-1-(cyclopropylsulfonylcarbamoyl)-2-vinylcyclopropanaminium 4-methylbenzenesulfonate; (1R,2S)-1-Amino-N-(cyclopropylsulfonyl)-2-ethenylcyclopropanecarboxamide 4-methylbenzenesulfonate (1:1); (1R,2S)-1-Amino-N-(cyclopropylsulfonyl)-2-vinylcyclopropane-1-carboxamide 4-methylbenzenesulfonate

(1R,2S)-1-Amino-N-(cyclopropylsulfonyl)-2-vinylcyclopropanecarboxamide 4-methylbenzenesulfonate

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Computed Properties

IUPAC Name:	(1R,2S)-1-amino-N-cyclopropylsulfonyl-2-ethenylcyclopropane-1-carboxamide4-methylbenzenesulfonic acid
Description:	(1R,2S)-1-Amino-N-(cyclopropylsulfonyl)-2-vinylcyclopropanecarboxamide 4-methylbenzenesulfonate acts as a reagent in the preparation, SAR of methoxyisoquinoline derivatives and discovery of asunaprevir (BMS-650032), an orally efficacious NS3 protease inhibitor for the treatment of hepatitis C virus infection.
Molecular Weight:	230.28 + (172.20)
Molecular Formula:	C9H14N2O3S·(C7H8O3S)
Canonical SMILES:	CC1=CC=C(C=C1)S(=O)(=O)O.C=CC1CC1(C(=O)NS(=O)(=O)C2CC2)N
InChI:	InChI=1S/C9H14N2O3S.C7H8O3S/c1-2-6-5-9(6,10)8(12)11-15(13,14)7-3-4-71-6-2-4-7(5-3-6)11(8,9)10/h2,6-7H,1,3-5,10H2,(H,11,12)2-5H,1H3,(H,8,9,10)/t6-,9-/m1./s1
InChI Key:	WILXYULVXUTJDF-SOWVLMPRSA-N

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