6-cyclobutyl-2-(4-pyrrolidin-1-ylphenyl)-4,5,7,8-tetrahydropyrazolo[3,4-d]azepine

Systemtic Name: 6-cyclobutyl-2-(4-pyrrolidin-1-ylphenyl)-4,5,7,8-tetrahydropyrazolo[3,4-d]azepine Openeye Name: 6-cyclobutyl-2-(4-pyrrolidin-1-ylphenyl)-4,5,7,8-tetrahydropyrazolo[3,4-d]azepine CAS Name: 6-cyclobutyl-2-[4-(1-pyrrolidinyl)phenyl]-4,5,7,8-tetrahydropyrazolo[3,4-d]azepine IUPAC Name: 6-cyclobutyl-2-(4-pyrrolidin-1-ylphenyl)-4,5,7,8-tetrahydropyrazolo[3,4-d]azepine Traditional Name: 6-cyclobutyl-2-(4-pyrrolidinophenyl)-4,5,7,8-tetrahydropyrazol[3,4-d]azepine Formula: C21H28N4 MolecularWeight: 336.47382

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)N3C=C4CCN(CCC4=N3)C5CCC5

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)N3C=C4CCN(CCC4=N3)C5CCC5

InChI

InChI=1S/C21H28N4/c1-2-13-23(12-1)19-6-8-20(9-7-19)25-16-17-10-14-24(18-4-3-5-18)15-11-21(17)22-25/h6-9,16,18H,1-5,10-15H2