(5R,5aS)-3-methyl-1-phenyl-5-pyridin-2-yl-5a,6,7,8-tetrahydro-4H-pyrazolo[3,4-e]indolizine-5-carbonitrile

Systemtic Name: (5R,5aS)-3-methyl-1-phenyl-5-pyridin-2-yl-5a,6,7,8-tetrahydro-4H-pyrazolo[3,4-e]indolizine-5-carbonitrile Openeye Name: (5R,5aS)-3-methyl-1-phenyl-5-(2-pyridyl)-5a,6,7,8-tetrahydro-4H-pyrazolo[3,4-e]indolizine-5-carbonitrile CAS Name: (5R,5aS)-3-methyl-1-phenyl-5-(2-pyridinyl)-5a,6,7,8-tetrahydro-4H-pyrazolo[3,4-e]indolizine-5-carbonitrile IUPAC Name: (5R,5aS)-3-methyl-1-phenyl-5-pyridin-2-yl-5a,6,7,8-tetrahydro-4H-pyrazolo[3,4-e]indolizine-5-carbonitrile Traditional Name: (5R,5aS)-3-methyl-1-phenyl-5-(2-pyridyl)-5a,6,7,8-tetrahydro-4H-pyrazol[3,4-e]indolizine-5-carbonitrile Formula: C22H21N5 MolecularWeight: 355.43564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1CC(C3N2CCC3)(C#N)C4=CC=CC=N4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1C[C@]([C@H]3N2CCC3)(C#N)C4=CC=CC=N4)C5=CC=CC=C5

InChI

InChI=1S/C22H21N5/c1-16-18-14-22(15-23,19-10-5-6-12-24-19)20-11-7-13-26(20)21(18)27(25-16)17-8-3-2-4-9-17/h2-6,8-10,12,20H,7,11,13-14H2,1H3/t20-,22-/m0/s1