8-cyclopentyl-2-[(4-piperazin-1-ylphenyl)amino]-6-(pyridin-2-ylmethyl)pyrido[2,3-d]pyrimidin-7-one

Systemtic Name: 8-cyclopentyl-2-[(4-piperazin-1-ylphenyl)amino]-6-(pyridin-2-ylmethyl)pyrido[2,3-d]pyrimidin-7-one Openeye Name: 8-cyclopentyl-2-(4-piperazin-1-ylanilino)-6-(2-pyridylmethyl)pyrido[2,3-d]pyrimidin-7-one CAS Name: 8-cyclopentyl-2-[4-(1-piperazinyl)anilino]-6-(2-pyridinylmethyl)-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 8-cyclopentyl-2-(4-piperazin-1-ylanilino)-6-(pyridin-2-ylmethyl)pyrido[2,3-d]pyrimidin-7-one Traditional Name: 8-cyclopentyl-2-(4-piperazinoanilino)-6-(2-pyridylmethyl)pyrido[2,3-d]pyrimidin-7-one Formula: C28H31N7O MolecularWeight: 481.59204

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=NC(=NC=C3C=C(C2=O)CC4=CC=CC=N4)NC5=CC=C(C=C5)N6CCNCC6

Isomeric SMILES

C1CCC(C1)N2C3=NC(=NC=C3C=C(C2=O)CC4=CC=CC=N4)NC5=CC=C(C=C5)N6CCNCC6

InChI

InChI=1S/C28H31N7O/c36-27-20(18-23-5-3-4-12-30-23)17-21-19-31-28(33-26(21)35(27)25-6-1-2-7-25)32-22-8-10-24(11-9-22)34-15-13-29-14-16-34/h3-5,8-12,17,19,25,29H,1-2,6-7,13-16,18H2,(H,31,32,33)