8-(1,5-diphenoxypentan-3-yl)-2-[(4-pyrazol-1-ylphenyl)amino]pyrido[2,3-d]pyrimidin-7-one

Systemtic Name: 8-(1,5-diphenoxypentan-3-yl)-2-[(4-pyrazol-1-ylphenyl)amino]pyrido[2,3-d]pyrimidin-7-one Openeye Name: 8-[3-phenoxy-1-(2-phenoxyethyl)propyl]-2-(4-pyrazol-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one CAS Name: 8-(1,5-diphenoxypentan-3-yl)-2-[4-(1-pyrazolyl)anilino]-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 8-(1,5-diphenoxypentan-3-yl)-2-(4-pyrazol-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one Traditional Name: 8-[3-phenoxy-1-(2-phenoxyethyl)propyl]-2-(4-pyrazol-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one Formula: C33H30N6O3 MolecularWeight: 558.6297

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCC(CCOC2=CC=CC=C2)N3C(=O)C=CC4=CN=C(N=C43)NC5=CC=C(C=C5)N6C=CC=N6

Isomeric SMILES

C1=CC=C(C=C1)OCCC(CCOC2=CC=CC=C2)N3C(=O)C=CC4=CN=C(N=C43)NC5=CC=C(C=C5)N6C=CC=N6

InChI

InChI=1S/C33H30N6O3/c40-31-17-12-25-24-34-33(36-26-13-15-27(16-14-26)38-21-7-20-35-38)37-32(25)39(31)28(18-22-41-29-8-3-1-4-9-29)19-23-42-30-10-5-2-6-11-30/h1-17,20-21,24,28H,18-19,22-23H2,(H,34,36,37)