1-[[5-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl]methyl]-1-cycloheptyl-3-(4-methylphenyl)thiourea

Systemtic Name: 1-[[5-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl]methyl]-1-cycloheptyl-3-(4-methylphenyl)thiourea Openeye Name: 1-[[5-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl]methyl]-1-cycloheptyl-3-(p-tolyl)thiourea CAS Name: 1-[[5-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl]methyl]-1-cycloheptyl-3-(4-methylphenyl)thiourea IUPAC Name: 1-[[5-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl]methyl]-1-cycloheptyl-3-(4-methylphenyl)thiourea Traditional Name: 1-[[5-(2-chlorobenzyl)-1H-pyrrol-2-yl]methyl]-1-cycloheptyl-3-(p-tolyl)thiourea Formula: C27H32ClN3S MolecularWeight: 466.08108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)N(CC2=CC=C(N2)CC3=CC=CC=C3Cl)C4CCCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)N(CC2=CC=C(N2)CC3=CC=CC=C3Cl)C4CCCCCC4

InChI

InChI=1S/C27H32ClN3S/c1-20-12-14-22(15-13-20)30-27(32)31(25-9-4-2-3-5-10-25)19-24-17-16-23(29-24)18-21-8-6-7-11-26(21)28/h6-8,11-17,25,29H,2-5,9-10,18-19H2,1H3,(H,30,32)