N3-(1,3-benzothiazol-2-ylmethyl)-N5-methyl-4-oxidanylidene-1-phenethyl-pyridine-3,5-dicarboxamide

Systemtic Name: N3-(1,3-benzothiazol-2-ylmethyl)-N5-methyl-4-oxidanylidene-1-phenethyl-pyridine-3,5-dicarboxamide Openeye Name: N3-(1,3-benzothiazol-2-ylmethyl)-N5-methyl-4-oxo-1-phenethyl-pyridine-3,5-dicarboxamide CAS Name: N3-(1,3-benzothiazol-2-ylmethyl)-N5-methyl-4-oxo-1-phenethylpyridine-3,5-dicarboxamide IUPAC Name: 3-N-(1,3-benzothiazol-2-ylmethyl)-5-N-methyl-4-oxo-1-phenethylpyridine-3,5-dicarboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-4-keto-N'-methyl-1-phenethyl-dinicotinamide Formula: C24H22N4O3S MolecularWeight: 446.52148

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CN(C=C(C1=O)C(=O)NCC2=NC3=CC=CC=C3S2)CCC4=CC=CC=C4

Isomeric SMILES

CNC(=O)C1=CN(C=C(C1=O)C(=O)NCC2=NC3=CC=CC=C3S2)CCC4=CC=CC=C4

InChI

InChI=1S/C24H22N4O3S/c1-25-23(30)17-14-28(12-11-16-7-3-2-4-8-16)15-18(22(17)29)24(31)26-13-21-27-19-9-5-6-10-20(19)32-21/h2-10,14-15H,11-13H2,1H3,(H,25,30)(H,26,31)