8-(1,5-diphenoxypentan-3-yl)-2-phenylazanyl-pyrido[2,3-d]pyrimidin-7-one

Systemtic Name: 8-(1,5-diphenoxypentan-3-yl)-2-phenylazanyl-pyrido[2,3-d]pyrimidin-7-one Openeye Name: 2-anilino-8-[3-phenoxy-1-(2-phenoxyethyl)propyl]pyrido[2,3-d]pyrimidin-7-one CAS Name: 2-anilino-8-(1,5-diphenoxypentan-3-yl)-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 2-anilino-8-(1,5-diphenoxypentan-3-yl)pyrido[2,3-d]pyrimidin-7-one Traditional Name: 2-anilino-8-[3-phenoxy-1-(2-phenoxyethyl)propyl]pyrido[2,3-d]pyrimidin-7-one Formula: C30H28N4O3 MolecularWeight: 492.56832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC=C3C=CC(=O)N(C3=N2)C(CCOC4=CC=CC=C4)CCOC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC=C3C=CC(=O)N(C3=N2)C(CCOC4=CC=CC=C4)CCOC5=CC=CC=C5

InChI

InChI=1S/C30H28N4O3/c35-28-17-16-23-22-31-30(32-24-10-4-1-5-11-24)33-29(23)34(28)25(18-20-36-26-12-6-2-7-13-26)19-21-37-27-14-8-3-9-15-27/h1-17,22,25H,18-21H2,(H,31,32,33)