1-cycloheptyl-1-[[4-(4-methylpiperazin-1-yl)phenyl]methyl]-3-(2,4,6-trimethylphenyl)urea

Systemtic Name: 1-cycloheptyl-1-[[4-(4-methylpiperazin-1-yl)phenyl]methyl]-3-(2,4,6-trimethylphenyl)urea Openeye Name: 1-cycloheptyl-1-[[4-(4-methylpiperazin-1-yl)phenyl]methyl]-3-(2,4,6-trimethylphenyl)urea CAS Name: 1-cycloheptyl-1-[[4-(4-methyl-1-piperazinyl)phenyl]methyl]-3-(2,4,6-trimethylphenyl)urea IUPAC Name: 1-cycloheptyl-1-[[4-(4-methylpiperazin-1-yl)phenyl]methyl]-3-(2,4,6-trimethylphenyl)urea Traditional Name: 1-cycloheptyl-3-mesityl-1-[4-(4-methylpiperazino)benzyl]urea Formula: C29H42N4O MolecularWeight: 462.66998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)N(CC2=CC=C(C=C2)N3CCN(CC3)C)C4CCCCCC4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)N(CC2=CC=C(C=C2)N3CCN(CC3)C)C4CCCCCC4)C

InChI

InChI=1S/C29H42N4O/c1-22-19-23(2)28(24(3)20-22)30-29(34)33(27-9-7-5-6-8-10-27)21-25-11-13-26(14-12-25)32-17-15-31(4)16-18-32/h11-14,19-20,27H,5-10,15-18,21H2,1-4H3,(H,30,34)