azepan-1-yl-[1-ethyl-5-[(phenylmethyl)amino]-4,5,6,7-tetrahydroindazol-3-yl]methanone

Systemtic Name: azepan-1-yl-[1-ethyl-5-[(phenylmethyl)amino]-4,5,6,7-tetrahydroindazol-3-yl]methanone Openeye Name: azepan-1-yl-[5-(benzylamino)-1-ethyl-4,5,6,7-tetrahydroindazol-3-yl]methanone CAS Name: 1-azepanyl-[1-ethyl-5-[(phenylmethyl)amino]-4,5,6,7-tetrahydroindazol-3-yl]methanone IUPAC Name: azepan-1-yl-[5-(benzylamino)-1-ethyl-4,5,6,7-tetrahydroindazol-3-yl]methanone Traditional Name: azepan-1-yl-[5-(benzylamino)-1-ethyl-4,5,6,7-tetrahydroindazol-3-yl]methanone Formula: C23H32N4O MolecularWeight: 380.52638

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)NCC3=CC=CC=C3)C(=N1)C(=O)N4CCCCCC4

Isomeric SMILES

CCN1C2=C(CC(CC2)NCC3=CC=CC=C3)C(=N1)C(=O)N4CCCCCC4

InChI

InChI=1S/C23H32N4O/c1-2-27-21-13-12-19(24-17-18-10-6-5-7-11-18)16-20(21)22(25-27)23(28)26-14-8-3-4-9-15-26/h5-7,10-11,19,24H,2-4,8-9,12-17H2,1H3