4-(6-cyclobutyl-4,5,7,8-tetrahydropyrazolo[3,4-d]azepin-2-yl)benzenecarbonitrile

Systemtic Name: 4-(6-cyclobutyl-4,5,7,8-tetrahydropyrazolo[3,4-d]azepin-2-yl)benzenecarbonitrile Openeye Name: 4-(6-cyclobutyl-4,5,7,8-tetrahydropyrazolo[3,4-d]azepin-2-yl)benzonitrile CAS Name: 4-(6-cyclobutyl-4,5,7,8-tetrahydropyrazolo[3,4-d]azepin-2-yl)benzonitrile IUPAC Name: 4-(6-cyclobutyl-4,5,7,8-tetrahydropyrazolo[3,4-d]azepin-2-yl)benzonitrile Traditional Name: 4-(6-cyclobutyl-4,5,7,8-tetrahydropyrazol[3,4-d]azepin-2-yl)benzonitrile Formula: C18H20N4 MolecularWeight: 292.3782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N2CCC3=CN(N=C3CC2)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CC(C1)N2CCC3=CN(N=C3CC2)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C18H20N4/c19-12-14-4-6-17(7-5-14)22-13-15-8-10-21(16-2-1-3-16)11-9-18(15)20-22/h4-7,13,16H,1-3,8-11H2