N-(1,3-benzothiazol-2-yl)-1-[(4-methylphenyl)methyl]-2-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-[(4-methylphenyl)methyl]-2-oxidanylidene-pyridine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-oxo-1-(p-tolylmethyl)pyridine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1-[(4-methylphenyl)methyl]-2-oxo-3-pyridinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-[(4-methylphenyl)methyl]-2-oxopyridine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-keto-1-(4-methylbenzyl)nicotinamide Formula: C21H17N3O2S MolecularWeight: 375.44358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=CC=C(C2=O)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=CC=C(C2=O)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H17N3O2S/c1-14-8-10-15(11-9-14)13-24-12-4-5-16(20(24)26)19(25)23-21-22-17-6-2-3-7-18(17)27-21/h2-12H,13H2,1H3,(H,22,23,25)