4-(2-propan-2-yl-5,6,7,8-tetrahydro-4H-pyrazolo[3,4-d]azepin-3-yl)benzenecarbonitrile

Systemtic Name: 4-(2-propan-2-yl-5,6,7,8-tetrahydro-4H-pyrazolo[3,4-d]azepin-3-yl)benzenecarbonitrile Openeye Name: 4-(2-isopropyl-5,6,7,8-tetrahydro-4H-pyrazolo[3,4-d]azepin-3-yl)benzonitrile CAS Name: 4-(2-propan-2-yl-5,6,7,8-tetrahydro-4H-pyrazolo[3,4-d]azepin-3-yl)benzonitrile IUPAC Name: 4-(2-propan-2-yl-5,6,7,8-tetrahydro-4H-pyrazolo[3,4-d]azepin-3-yl)benzonitrile Traditional Name: 4-(2-isopropyl-5,6,7,8-tetrahydro-4H-pyrazol[3,4-d]azepin-3-yl)benzonitrile Formula: C17H20N4 MolecularWeight: 280.3675

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=C2CCNCCC2=N1)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)N1C(=C2CCNCCC2=N1)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H20N4/c1-12(2)21-17(14-5-3-13(11-18)4-6-14)15-7-9-19-10-8-16(15)20-21/h3-6,12,19H,7-10H2,1-2H3