5-(2-methyl-1,3-benzothiazol-5-yl)-N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-oxidanylidene-1H-pyridine-3-carboxamide

Systemtic Name: 5-(2-methyl-1,3-benzothiazol-5-yl)-N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-oxidanylidene-1H-pyridine-3-carboxamide Openeye Name: 5-(2-methyl-1,3-benzothiazol-5-yl)-N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-oxo-1H-pyridine-3-carboxamide CAS Name: 5-(2-methyl-1,3-benzothiazol-5-yl)-N-[4-[(4-methyl-1-piperazinyl)methyl]phenyl]-2-oxo-1H-pyridine-3-carboxamide IUPAC Name: 5-(2-methyl-1,3-benzothiazol-5-yl)-N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-oxo-1H-pyridine-3-carboxamide Traditional Name: 2-keto-5-(2-methyl-1,3-benzothiazol-5-yl)-N-[4-[(4-methylpiperazino)methyl]phenyl]-1H-pyridine-3-carboxamide Formula: C26H27N5O2S MolecularWeight: 473.58988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)C3=CNC(=O)C(=C3)C(=O)NC4=CC=C(C=C4)CN5CCN(CC5)C

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)C3=CNC(=O)C(=C3)C(=O)NC4=CC=C(C=C4)CN5CCN(CC5)C

InChI

InChI=1S/C26H27N5O2S/c1-17-28-23-14-19(5-8-24(23)34-17)20-13-22(25(32)27-15-20)26(33)29-21-6-3-18(4-7-21)16-31-11-9-30(2)10-12-31/h3-8,13-15H,9-12,16H2,1-2H3,(H,27,32)(H,29,33)