N-(4-methyl-1,3-benzothiazol-2-yl)-1-[(3-methylphenyl)methyl]-6-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-[(3-methylphenyl)methyl]-6-oxidanylidene-pyridine-3-carboxamide Openeye Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-(m-tolylmethyl)-6-oxo-pyridine-3-carboxamide CAS Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-[(3-methylphenyl)methyl]-6-oxo-3-pyridinecarboxamide IUPAC Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-[(3-methylphenyl)methyl]-6-oxopyridine-3-carboxamide Traditional Name: 6-keto-N-(4-methyl-1,3-benzothiazol-2-yl)-1-(3-methylbenzyl)nicotinamide Formula: C22H19N3O2S MolecularWeight: 389.47016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=C(C=CC2=O)C(=O)NC3=NC4=C(C=CC=C4S3)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=C(C=CC2=O)C(=O)NC3=NC4=C(C=CC=C4S3)C

InChI

InChI=1S/C22H19N3O2S/c1-14-5-3-7-16(11-14)12-25-13-17(9-10-19(25)26)21(27)24-22-23-20-15(2)6-4-8-18(20)28-22/h3-11,13H,12H2,1-2H3,(H,23,24,27)