2-[(2,5-diphenyl-3,4-dihydropyrazol-4-yl)methyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine

Systemtic Name: 2-[(2,5-diphenyl-3,4-dihydropyrazol-4-yl)methyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine Openeye Name: 2-[(2,5-diphenyl-3,4-dihydropyrazol-4-yl)methyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine CAS Name: 2-[(2,5-diphenyl-3,4-dihydropyrazol-4-yl)methyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine IUPAC Name: 2-[(2,5-diphenyl-3,4-dihydropyrazol-4-yl)methyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine Traditional Name: [2-[(1,3-diphenyl-2-pyrazolin-4-yl)methyl]-3,4,5,6-tetrahydro-2H-azepin-7-yl]amine Formula: C22H26N4 MolecularWeight: 346.46864

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NC(C1)CC2CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)N

Isomeric SMILES

C1CCC(=NC(C1)CC2CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)N

InChI

InChI=1S/C22H26N4/c23-21-14-8-7-11-19(24-21)15-18-16-26(20-12-5-2-6-13-20)25-22(18)17-9-3-1-4-10-17/h1-6,9-10,12-13,18-19H,7-8,11,14-16H2,(H2,23,24)