methyl 3-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]benzoate

Systemtic Name: methyl 3-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]benzoate Openeye Name: methyl 3-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]benzoate CAS Name: 3-[[(1-methyl-2-benzimidazolyl)thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(1-methylbenzimidazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 3-[[(1-methylbenzimidazol-2-yl)thio]methyl]benzoic acid methyl ester Formula: C17H16N2O2S MolecularWeight: 312.38614

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1SCC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CN1C2=CC=CC=C2N=C1SCC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C17H16N2O2S/c1-19-15-9-4-3-8-14(15)18-17(19)22-11-12-6-5-7-13(10-12)16(20)21-2/h3-10H,11H2,1-2H3