1-(4-ethylphenyl)-3-pyridin-3-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine

Systemtic Name: 1-(4-ethylphenyl)-3-pyridin-3-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(4-ethylphenyl)-3-(3-pyridyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(4-ethylphenyl)-3-(3-pyridinyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(4-ethylphenyl)-3-pyridin-3-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-(4-ethylphenyl)-3-(3-pyridyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C20H22N4 MolecularWeight: 318.41548

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C3=NCCCCC3=C(N2)C4=CN=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)N2C3=NCCCCC3=C(N2)C4=CN=CC=C4

InChI

InChI=1S/C20H22N4/c1-2-15-8-10-17(11-9-15)24-20-18(7-3-4-13-22-20)19(23-24)16-6-5-12-21-14-16/h5-6,8-12,14,23H,2-4,7,13H2,1H3