4-[[3-[1-benzothiophen-2-ylsulfonyl(methyl)amino]-2-oxidanylidene-pyrrolidin-1-yl]methyl]thiophene-2-carboximidamide

Systemtic Name: 4-[[3-[1-benzothiophen-2-ylsulfonyl(methyl)amino]-2-oxidanylidene-pyrrolidin-1-yl]methyl]thiophene-2-carboximidamide Openeye Name: 4-[[3-[benzothiophen-2-ylsulfonyl(methyl)amino]-2-oxo-pyrrolidin-1-yl]methyl]thiophene-2-carboxamidine CAS Name: 4-[[3-[1-benzothiophen-2-ylsulfonyl(methyl)amino]-2-oxo-1-pyrrolidinyl]methyl]-2-thiophenecarboximidamide IUPAC Name: 4-[[3-[1-benzothiophen-2-ylsulfonyl(methyl)amino]-2-oxopyrrolidin-1-yl]methyl]thiophene-2-carboximidamide Traditional Name: 4-[[3-[benzothiophen-2-ylsulfonyl(methyl)amino]-2-keto-pyrrolidino]methyl]thiophene-2-carboxamidine Formula: C19H20N4O3S3 MolecularWeight: 448.5821

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(C1=O)CC2=CSC(=C2)C(=N)N)S(=O)(=O)C3=CC4=CC=CC=C4S3

Isomeric SMILES

CN(C1CCN(C1=O)CC2=CSC(=C2)C(=N)N)S(=O)(=O)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C19H20N4O3S3/c1-22(29(25,26)17-9-13-4-2-3-5-15(13)28-17)14-6-7-23(19(14)24)10-12-8-16(18(20)21)27-11-12/h2-5,8-9,11,14H,6-7,10H2,1H3,(H3,20,21)