N-(benzimidazol-1-yl)-2-(3,4-dimethylphenyl)sulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(benzimidazol-1-yl)-2-(3,4-dimethylphenyl)sulfanyl-pyridine-3-carboxamide Openeye Name: N-(benzimidazol-1-yl)-2-(3,4-dimethylphenyl)sulfanyl-pyridine-3-carboxamide CAS Name: N-(1-benzimidazolyl)-2-[(3,4-dimethylphenyl)thio]-3-pyridinecarboxamide IUPAC Name: N-(benzimidazol-1-yl)-2-(3,4-dimethylphenyl)sulfanylpyridine-3-carboxamide Traditional Name: N-(benzimidazol-1-yl)-2-[(3,4-dimethylphenyl)thio]nicotinamide Formula: C21H18N4OS MolecularWeight: 374.45882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)NN3C=NC4=CC=CC=C43)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)NN3C=NC4=CC=CC=C43)C

InChI

InChI=1S/C21H18N4OS/c1-14-9-10-16(12-15(14)2)27-21-17(6-5-11-22-21)20(26)24-25-13-23-18-7-3-4-8-19(18)25/h3-13H,1-2H3,(H,24,26)