8-[(4-methylsulfanylphenyl)methyl]-2-[(4-piperidin-1-ylphenyl)amino]pyrido[2,3-d]pyrimidin-7-one

Systemtic Name: 8-[(4-methylsulfanylphenyl)methyl]-2-[(4-piperidin-1-ylphenyl)amino]pyrido[2,3-d]pyrimidin-7-one Openeye Name: 8-[(4-methylsulfanylphenyl)methyl]-2-[4-(1-piperidyl)anilino]pyrido[2,3-d]pyrimidin-7-one CAS Name: 8-[[4-(methylthio)phenyl]methyl]-2-[4-(1-piperidinyl)anilino]-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 8-[(4-methylsulfanylphenyl)methyl]-2-(4-piperidin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one Traditional Name: 8-[4-(methylthio)benzyl]-2-(4-piperidinoanilino)pyrido[2,3-d]pyrimidin-7-one Formula: C26H27N5OS MolecularWeight: 457.59048

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CN2C(=O)C=CC3=CN=C(N=C32)NC4=CC=C(C=C4)N5CCCCC5

Isomeric SMILES

CSC1=CC=C(C=C1)CN2C(=O)C=CC3=CN=C(N=C32)NC4=CC=C(C=C4)N5CCCCC5

InChI

InChI=1S/C26H27N5OS/c1-33-23-12-5-19(6-13-23)18-31-24(32)14-7-20-17-27-26(29-25(20)31)28-21-8-10-22(11-9-21)30-15-3-2-4-16-30/h5-14,17H,2-4,15-16,18H2,1H3,(H,27,28,29)