5-bromanyl-2-[4-[(6-methoxypyridin-3-yl)methylamino]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]benzenecarbonitrile

Systemtic Name: 5-bromanyl-2-[4-[(6-methoxypyridin-3-yl)methylamino]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]benzenecarbonitrile Openeye Name: 5-bromo-2-[4-[(6-methoxy-3-pyridyl)methylamino]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]benzonitrile CAS Name: 5-bromo-2-[4-[(6-methoxy-3-pyridinyl)methylamino]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]benzonitrile IUPAC Name: 5-bromo-2-[4-[(6-methoxypyridin-3-yl)methylamino]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]benzonitrile Traditional Name: 5-bromo-2-[4-[(6-methoxy-3-pyridyl)methylamino]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]benzonitrile Formula: C21H19BrN6O MolecularWeight: 451.31916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)CNC2=NC=NC3=C2CN(CC3)C4=C(C=C(C=C4)Br)C#N

Isomeric SMILES

COC1=NC=C(C=C1)CNC2=NC=NC3=C2CN(CC3)C4=C(C=C(C=C4)Br)C#N

InChI

InChI=1S/C21H19BrN6O/c1-29-20-5-2-14(10-24-20)11-25-21-17-12-28(7-6-18(17)26-13-27-21)19-4-3-16(22)8-15(19)9-23/h2-5,8,10,13H,6-7,11-12H2,1H3,(H,25,26,27)