1-[4-(4-azanyl-5-oxidanylidene-pyrido[2,3-d]pyrimidin-8-yl)phenyl]-3-[4-(piperidin-4-ylmethoxy)-3-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-[4-(4-azanyl-5-oxidanylidene-pyrido[2,3-d]pyrimidin-8-yl)phenyl]-3-[4-(piperidin-4-ylmethoxy)-3-(trifluoromethyl)phenyl]urea Openeye Name: 1-[4-(4-amino-5-oxo-pyrido[2,3-d]pyrimidin-8-yl)phenyl]-3-[4-(4-piperidylmethoxy)-3-(trifluoromethyl)phenyl]urea CAS Name: 1-[4-(4-amino-5-oxo-8-pyrido[2,3-d]pyrimidinyl)phenyl]-3-[4-(4-piperidinylmethoxy)-3-(trifluoromethyl)phenyl]urea IUPAC Name: 1-[4-(4-amino-5-oxopyrido[2,3-d]pyrimidin-8-yl)phenyl]-3-[4-(piperidin-4-ylmethoxy)-3-(trifluoromethyl)phenyl]urea Traditional Name: 1-[4-(4-amino-5-keto-pyrido[2,3-d]pyrimidin-8-yl)phenyl]-3-[4-(4-piperidylmethoxy)-3-(trifluoromethyl)phenyl]urea Formula: C27H26F3N7O3 MolecularWeight: 553.53565

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1COC2=C(C=C(C=C2)NC(=O)NC3=CC=C(C=C3)N4C=CC(=O)C5=C4N=CN=C5N)C(F)(F)F

Isomeric SMILES

C1CNCCC1COC2=C(C=C(C=C2)NC(=O)NC3=CC=C(C=C3)N4C=CC(=O)C5=C4N=CN=C5N)C(F)(F)F

InChI

InChI=1S/C27H26F3N7O3/c28-27(29,30)20-13-18(3-6-22(20)40-14-16-7-10-32-11-8-16)36-26(39)35-17-1-4-19(5-2-17)37-12-9-21(38)23-24(31)33-15-34-25(23)37/h1-6,9,12-13,15-16,32H,7-8,10-11,14H2,(H2,31,33,34)(H2,35,36,39)