methyl 3-(2-sulfanylidene-3H-benzimidazol-1-yl)butanoate

Systemtic Name: methyl 3-(2-sulfanylidene-3H-benzimidazol-1-yl)butanoate Openeye Name: methyl 3-(2-thioxo-3H-benzimidazol-1-yl)butanoate CAS Name: 3-(2-sulfanylidene-3H-benzimidazol-1-yl)butanoic acid methyl ester IUPAC Name: methyl 3-(2-sulfanylidene-3H-benzimidazol-1-yl)butanoate Traditional Name: 3-(2-thioxo-3H-benzimidazol-1-yl)butyric acid methyl ester Formula: C12H14N2O2S MolecularWeight: 250.31676

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC)N1C2=CC=CC=C2NC1=S

Isomeric SMILES

CC(CC(=O)OC)N1C2=CC=CC=C2NC1=S

InChI

InChI=1S/C12H14N2O2S/c1-8(7-11(15)16-2)14-10-6-4-3-5-9(10)13-12(14)17/h3-6,8H,7H2,1-2H3,(H,13,17)