8-(1-phenylprop-2-ynyl)-2-[(4-piperidin-1-ylphenyl)amino]pyrido[2,3-d]pyrimidin-7-one

Systemtic Name: 8-(1-phenylprop-2-ynyl)-2-[(4-piperidin-1-ylphenyl)amino]pyrido[2,3-d]pyrimidin-7-one Openeye Name: 8-(1-phenylprop-2-ynyl)-2-[4-(1-piperidyl)anilino]pyrido[2,3-d]pyrimidin-7-one CAS Name: 8-(1-phenylprop-2-ynyl)-2-[4-(1-piperidinyl)anilino]-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 8-(1-phenylprop-2-ynyl)-2-(4-piperidin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one Traditional Name: 8-(1-phenylprop-2-ynyl)-2-(4-piperidinoanilino)pyrido[2,3-d]pyrimidin-7-one Formula: C27H25N5O MolecularWeight: 435.5203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC(C1=CC=CC=C1)N2C(=O)C=CC3=CN=C(N=C32)NC4=CC=C(C=C4)N5CCCCC5

Isomeric SMILES

C#CC(C1=CC=CC=C1)N2C(=O)C=CC3=CN=C(N=C32)NC4=CC=C(C=C4)N5CCCCC5

InChI

InChI=1S/C27H25N5O/c1-2-24(20-9-5-3-6-10-20)32-25(33)16-11-21-19-28-27(30-26(21)32)29-22-12-14-23(15-13-22)31-17-7-4-8-18-31/h1,3,5-6,9-16,19,24H,4,7-8,17-18H2,(H,28,29,30)