3-(4-methylnaphthalen-2-yl)-1-phenyl-1-[1-(4-phenylpiperazin-1-yl)cyclohexyl]urea dihydrochloride

Systemtic Name: 3-(4-methylnaphthalen-2-yl)-1-phenyl-1-[1-(4-phenylpiperazin-1-yl)cyclohexyl]urea dihydrochloride Openeye Name: 3-(4-methyl-2-naphthyl)-1-phenyl-1-[1-(4-phenylpiperazin-1-yl)cyclohexyl]urea dihydrochloride CAS Name: 3-(4-methyl-2-naphthalenyl)-1-phenyl-1-[1-(4-phenyl-1-piperazinyl)cyclohexyl]urea dihydrochloride IUPAC Name: 3-(4-methylnaphthalen-2-yl)-1-phenyl-1-[1-(4-phenylpiperazin-1-yl)cyclohexyl]urea dihydrochloride Traditional Name: 3-(4-methyl-2-naphthyl)-1-phenyl-1-[1-(4-phenylpiperazino)cyclohexyl]urea dihydrochloride Formula: C34H40Cl2N4O MolecularWeight: 591.6136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=CC=CC=C12)NC(=O)N(C3=CC=CC=C3)C4(CCCCC4)N5CCN(CC5)C6=CC=CC=C6.Cl.Cl

Isomeric SMILES

CC1=CC(=CC2=CC=CC=C12)NC(=O)N(C3=CC=CC=C3)C4(CCCCC4)N5CCN(CC5)C6=CC=CC=C6.Cl.Cl

InChI

InChI=1S/C34H38N4O.2ClH/c1-27-25-29(26-28-13-9-10-18-32(27)28)35-33(39)38(31-16-7-3-8-17-31)34(19-11-4-12-20-34)37-23-21-36(22-24-37)30-14-5-2-6-15-30;;/h2-3,5-10,13-18,25-26H,4,11-12,19-24H2,1H3,(H,35,39);2*1H