8-(4-tert-butylcyclohexyl)-2-[[4-(4-methylpiperazin-1-yl)phenyl]amino]pyrido[2,3-d]pyrimidin-7-one

Systemtic Name: 8-(4-tert-butylcyclohexyl)-2-[[4-(4-methylpiperazin-1-yl)phenyl]amino]pyrido[2,3-d]pyrimidin-7-one Openeye Name: 8-(4-tert-butylcyclohexyl)-2-[4-(4-methylpiperazin-1-yl)anilino]pyrido[2,3-d]pyrimidin-7-one CAS Name: 8-(4-tert-butylcyclohexyl)-2-[4-(4-methyl-1-piperazinyl)anilino]-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 8-(4-tert-butylcyclohexyl)-2-[4-(4-methylpiperazin-1-yl)anilino]pyrido[2,3-d]pyrimidin-7-one Traditional Name: 8-(4-tert-butylcyclohexyl)-2-[4-(4-methylpiperazino)anilino]pyrido[2,3-d]pyrimidin-7-one Formula: C28H38N6O MolecularWeight: 474.64092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)N2C(=O)C=CC3=CN=C(N=C32)NC4=CC=C(C=C4)N5CCN(CC5)C

Isomeric SMILES

CC(C)(C)C1CCC(CC1)N2C(=O)C=CC3=CN=C(N=C32)NC4=CC=C(C=C4)N5CCN(CC5)C

InChI

InChI=1S/C28H38N6O/c1-28(2,3)21-6-10-24(11-7-21)34-25(35)14-5-20-19-29-27(31-26(20)34)30-22-8-12-23(13-9-22)33-17-15-32(4)16-18-33/h5,8-9,12-14,19,21,24H,6-7,10-11,15-18H2,1-4H3,(H,29,30,31)