2-[4-(1-methylazetidin-3-yl)piperazin-1-yl]-6-phenyl-7-[4-[[4-(3-pyridin-2-yl-1H-1,2,4-triazol-5-yl)piperidin-1-yl]methyl]phenyl]pyrido[2,3-d]pyrimidine

Systemtic Name: 2-[4-(1-methylazetidin-3-yl)piperazin-1-yl]-6-phenyl-7-[4-[[4-(3-pyridin-2-yl-1H-1,2,4-triazol-5-yl)piperidin-1-yl]methyl]phenyl]pyrido[2,3-d]pyrimidine Openeye Name: 2-[4-(1-methylazetidin-3-yl)piperazin-1-yl]-6-phenyl-7-[4-[[4-[3-(2-pyridyl)-1H-1,2,4-triazol-5-yl]-1-piperidyl]methyl]phenyl]pyrido[2,3-d]pyrimidine CAS Name: 2-[4-(1-methyl-3-azetidinyl)-1-piperazinyl]-6-phenyl-7-[4-[[4-[3-(2-pyridinyl)-1H-1,2,4-triazol-5-yl]-1-piperidinyl]methyl]phenyl]pyrido[2,3-d]pyrimidine IUPAC Name: 2-[4-(1-methylazetidin-3-yl)piperazin-1-yl]-6-phenyl-7-[4-[[4-(3-pyridin-2-yl-1H-1,2,4-triazol-5-yl)piperidin-1-yl]methyl]phenyl]pyrido[2,3-d]pyrimidine Traditional Name: 2-[4-(1-methylazetidin-3-yl)piperazino]-6-phenyl-7-[4-[[4-[3-(2-pyridyl)-1H-1,2,4-triazol-5-yl]piperidino]methyl]phenyl]pyrido[2,3-d]pyrimidine Formula: C40H43N11 MolecularWeight: 677.84312

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(C1)N2CCN(CC2)C3=NC4=NC(=C(C=C4C=N3)C5=CC=CC=C5)C6=CC=C(C=C6)CN7CCC(CC7)C8=NC(=NN8)C9=CC=CC=N9

Isomeric SMILES

CN1CC(C1)N2CCN(CC2)C3=NC4=NC(=C(C=C4C=N3)C5=CC=CC=C5)C6=CC=C(C=C6)CN7CCC(CC7)C8=NC(=NN8)C9=CC=CC=N9

InChI

InChI=1S/C40H43N11/c1-48-26-33(27-48)50-19-21-51(22-20-50)40-42-24-32-23-34(29-7-3-2-4-8-29)36(43-37(32)45-40)30-12-10-28(11-13-30)25-49-17-14-31(15-18-49)38-44-39(47-46-38)35-9-5-6-16-41-35/h2-13,16,23-24,31,33H,14-15,17-22,25-27H2,1H3,(H,44,46,47)