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

Systemtic Name: 2-[[4-(4-methylpiperazin-1-yl)phenyl]amino]-8-(3-phenylmethoxypropyl)pyrido[2,3-d]pyrimidin-7-one Openeye Name: 8-(3-benzyloxypropyl)-2-[4-(4-methylpiperazin-1-yl)anilino]pyrido[2,3-d]pyrimidin-7-one CAS Name: 2-[4-(4-methyl-1-piperazinyl)anilino]-8-(3-phenylmethoxypropyl)-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 2-[4-(4-methylpiperazin-1-yl)anilino]-8-(3-phenylmethoxypropyl)pyrido[2,3-d]pyrimidin-7-one Traditional Name: 8-(3-benzoxypropyl)-2-[4-(4-methylpiperazino)anilino]pyrido[2,3-d]pyrimidin-7-one Formula: C28H32N6O2 MolecularWeight: 484.59268

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C4C=CC(=O)N(C4=N3)CCCOCC5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C4C=CC(=O)N(C4=N3)CCCOCC5=CC=CC=C5

InChI

InChI=1S/C28H32N6O2/c1-32-15-17-33(18-16-32)25-11-9-24(10-12-25)30-28-29-20-23-8-13-26(35)34(27(23)31-28)14-5-19-36-21-22-6-3-2-4-7-22/h2-4,6-13,20H,5,14-19,21H2,1H3,(H,29,30,31)