(2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-methyl-butanoate

Systemtic Name: (2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-methyl-butanoate Openeye Name: (2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]-3-methyl-butanoate CAS Name: (2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]-3-methylbutanoate IUPAC Name: (2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-methylbutanoate Traditional Name: (2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylene)-4-keto-2-thioxo-thiazolidin-3-yl]-3-methyl-butyrate Formula: C16H14N3O3S2- MolecularWeight: 360.43066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])N1C(=O)C(=CC2=NC3=CC=CC=C3N2)SC1=S

Isomeric SMILES

CC(C)[C@H](C(=O)[O-])N1C(=O)/C(=C\C2=NC3=CC=CC=C3N2)/SC1=S

InChI

InChI=1S/C16H15N3O3S2/c1-8(2)13(15(21)22)19-14(20)11(24-16(19)23)7-12-17-9-5-3-4-6-10(9)18-12/h3-8,13H,1-2H3,(H,17,18)(H,21,22)/p-1/b11-7+/t13-/m1/s1