4-[4-methyl-7-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)pyrido[2,3-d]pyrimidin-8-yl]-N-[(4-methylsulfonylphenyl)methyl]benzamide

Systemtic Name: 4-[4-methyl-7-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)pyrido[2,3-d]pyrimidin-8-yl]-N-[(4-methylsulfonylphenyl)methyl]benzamide Openeye Name: 4-[4-methyl-7-oxo-2-[4-(2-pyridyl)piperazin-1-yl]pyrido[2,3-d]pyrimidin-8-yl]-N-[(4-methylsulfonylphenyl)methyl]benzamide CAS Name: 4-[4-methyl-7-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]-8-pyrido[2,3-d]pyrimidinyl]-N-[(4-methylsulfonylphenyl)methyl]benzamide IUPAC Name: 4-[4-methyl-7-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)pyrido[2,3-d]pyrimidin-8-yl]-N-[(4-methylsulfonylphenyl)methyl]benzamide Traditional Name: 4-[7-keto-4-methyl-2-[4-(2-pyridyl)piperazino]pyrido[2,3-d]pyrimidin-8-yl]-N-(4-mesylbenzyl)benzamide Formula: C32H31N7O4S MolecularWeight: 609.69804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC(=O)N(C2=NC(=N1)N3CCN(CC3)C4=CC=CC=N4)C5=CC=C(C=C5)C(=O)NCC6=CC=C(C=C6)S(=O)(=O)C

Isomeric SMILES

CC1=C2C=CC(=O)N(C2=NC(=N1)N3CCN(CC3)C4=CC=CC=N4)C5=CC=C(C=C5)C(=O)NCC6=CC=C(C=C6)S(=O)(=O)C

InChI

InChI=1S/C32H31N7O4S/c1-22-27-14-15-29(40)39(30(27)36-32(35-22)38-19-17-37(18-20-38)28-5-3-4-16-33-28)25-10-8-24(9-11-25)31(41)34-21-23-6-12-26(13-7-23)44(2,42)43/h3-16H,17-21H2,1-2H3,(H,34,41)