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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CN(C(=O)C=C3)CC4=CC=CC=C4C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CN(C(=O)C=C3)CC4=CC=CC=C4C

InChI

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