methyl 4-[3-(1H-benzimidazol-2-ylmethyl)-4-oxidanylidene-1,3-thiazolidin-2-yl]benzoate

Systemtic Name: methyl 4-[3-(1H-benzimidazol-2-ylmethyl)-4-oxidanylidene-1,3-thiazolidin-2-yl]benzoate Openeye Name: methyl 4-[3-(1H-benzimidazol-2-ylmethyl)-4-oxo-thiazolidin-2-yl]benzoate CAS Name: 4-[3-(1H-benzimidazol-2-ylmethyl)-4-oxo-2-thiazolidinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(1H-benzimidazol-2-ylmethyl)-4-oxo-1,3-thiazolidin-2-yl]benzoate Traditional Name: 4-[3-(1H-benzimidazol-2-ylmethyl)-4-keto-thiazolidin-2-yl]benzoic acid methyl ester Formula: C19H17N3O3S MolecularWeight: 367.42158

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2N(C(=O)CS2)CC3=NC4=CC=CC=C4N3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2N(C(=O)CS2)CC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C19H17N3O3S/c1-25-19(24)13-8-6-12(7-9-13)18-22(17(23)11-26-18)10-16-20-14-4-2-3-5-15(14)21-16/h2-9,18H,10-11H2,1H3,(H,20,21)