2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]ethanamide

Systemtic Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]ethanamide Openeye Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-[3-(2-thioxo-1H-imidazol-3-yl)phenyl]acetamide CAS Name: 2-[(4-acetamidophenyl)sulfonyl-methylamino]-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]acetamide IUPAC Name: 2-[(4-acetamidophenyl)sulfonyl-methylamino]-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]acetamide Traditional Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-[3-(2-thioxo-4-imidazolin-1-yl)phenyl]acetamide Formula: C20H21N5O4S2 MolecularWeight: 459.54184

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=CC=CC(=C2)N3C=CNC3=S

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=CC=CC(=C2)N3C=CNC3=S

InChI

InChI=1S/C20H21N5O4S2/c1-14(26)22-15-6-8-18(9-7-15)31(28,29)24(2)13-19(27)23-16-4-3-5-17(12-16)25-11-10-21-20(25)30/h3-12H,13H2,1-2H3,(H,21,30)(H,22,26)(H,23,27)