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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(C=CC2=O)C(=O)NC3=NC4=C(S3)C=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(C=CC2=O)C(=O)NC3=NC4=C(S3)C=C(C=C4)C

InChI

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