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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C2=CC=CC=C2NC1=S)C(=O)OC

Isomeric SMILES

CC(CN1C2=CC=CC=C2NC1=S)C(=O)OC

InChI

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