1-[(2S)-2-butyl-4-naphthalen-1-ylcarbonyl-piperazin-1-yl]-2-[3-(naphthalen-2-ylmethyl)imidazol-4-yl]ethanone dihydrochloride

Systemtic Name: 1-[(2S)-2-butyl-4-naphthalen-1-ylcarbonyl-piperazin-1-yl]-2-[3-(naphthalen-2-ylmethyl)imidazol-4-yl]ethanone dihydrochloride Openeye Name: 1-[(2S)-2-butyl-4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-[3-(2-naphthylmethyl)imidazol-4-yl]ethanone dihydrochloride CAS Name: 1-[(2S)-2-butyl-4-[1-naphthalenyl(oxo)methyl]-1-piperazinyl]-2-[3-(2-naphthalenylmethyl)-4-imidazolyl]ethanone dihydrochloride IUPAC Name: 1-[(2S)-2-butyl-4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-[3-(naphthalen-2-ylmethyl)imidazol-4-yl]ethanone dihydrochloride Traditional Name: 1-[(2S)-2-butyl-4-(1-naphthoyl)piperazino]-2-[3-(2-naphthylmethyl)imidazol-4-yl]ethanone dihydrochloride Formula: C35H38Cl2N4O2 MolecularWeight: 617.60782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CCN1C(=O)CC2=CN=CN2CC3=CC4=CC=CC=C4C=C3)C(=O)C5=CC=CC6=CC=CC=C65.Cl.Cl

Isomeric SMILES

CCCC[C@H]1CN(CCN1C(=O)CC2=CN=CN2CC3=CC4=CC=CC=C4C=C3)C(=O)C5=CC=CC6=CC=CC=C65.Cl.Cl

InChI

InChI=1S/C35H36N4O2.2ClH/c1-2-3-13-30-24-37(35(41)33-15-8-12-28-10-6-7-14-32(28)33)18-19-39(30)34(40)21-31-22-36-25-38(31)23-26-16-17-27-9-4-5-11-29(27)20-26;;/h4-12,14-17,20,22,25,30H,2-3,13,18-19,21,23-24H2,1H3;2*1H/t30-;;/m0../s1