methyl 2-[1-(3-methylphenyl)benzimidazol-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[1-(3-methylphenyl)benzimidazol-2-yl]sulfanylethanoate Openeye Name: methyl 2-[1-(m-tolyl)benzimidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-(3-methylphenyl)-2-benzimidazolyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[1-(3-methylphenyl)benzimidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-(m-tolyl)benzimidazol-2-yl]thio]acetic acid methyl ester Formula: C17H16N2O2S MolecularWeight: 312.38614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C3=CC=CC=C3N=C2SCC(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)N2C3=CC=CC=C3N=C2SCC(=O)OC

InChI

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