1-cycloheptyl-1-[[1-[(2,4-dimethylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-methylphenyl)thiourea

Systemtic Name: 1-cycloheptyl-1-[[1-[(2,4-dimethylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-methylphenyl)thiourea Openeye Name: 1-cycloheptyl-1-[[1-[(2,4-dimethylphenyl)methyl]pyrrol-2-yl]methyl]-3-(p-tolyl)thiourea CAS Name: 1-cycloheptyl-1-[[1-[(2,4-dimethylphenyl)methyl]-2-pyrrolyl]methyl]-3-(4-methylphenyl)thiourea IUPAC Name: 1-cycloheptyl-1-[[1-[(2,4-dimethylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-methylphenyl)thiourea Traditional Name: 1-cycloheptyl-1-[[1-(2,4-dimethylbenzyl)pyrrol-2-yl]methyl]-3-(p-tolyl)thiourea Formula: C29H37N3S MolecularWeight: 459.68918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)N(CC2=CC=CN2CC3=C(C=C(C=C3)C)C)C4CCCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)N(CC2=CC=CN2CC3=C(C=C(C=C3)C)C)C4CCCCCC4

InChI

InChI=1S/C29H37N3S/c1-22-13-16-26(17-14-22)30-29(33)32(27-9-6-4-5-7-10-27)21-28-11-8-18-31(28)20-25-15-12-23(2)19-24(25)3/h8,11-19,27H,4-7,9-10,20-21H2,1-3H3,(H,30,33)