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

Systemtic Name: 1-[(3-chlorophenyl)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)-6-oxidanylidene-pyridine-3-carboxamide Openeye Name: 1-[(3-chlorophenyl)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)-6-oxo-pyridine-3-carboxamide CAS Name: 1-[(3-chlorophenyl)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)-6-oxo-3-pyridinecarboxamide IUPAC Name: 1-[(3-chlorophenyl)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)-6-oxopyridine-3-carboxamide Traditional Name: 1-(3-chlorobenzyl)-6-keto-N-(4-methyl-1,3-benzothiazol-2-yl)nicotinamide Formula: C21H16ClN3O2S MolecularWeight: 409.88864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CN(C(=O)C=C3)CC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CN(C(=O)C=C3)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H16ClN3O2S/c1-13-4-2-7-17-19(13)23-21(28-17)24-20(27)15-8-9-18(26)25(12-15)11-14-5-3-6-16(22)10-14/h2-10,12H,11H2,1H3,(H,23,24,27)