1-[[5-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl]methyl]-1-cycloheptyl-3-(2,6-dimethylphenyl)thiourea

Systemtic Name: 1-[[5-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl]methyl]-1-cycloheptyl-3-(2,6-dimethylphenyl)thiourea Openeye Name: 1-[[5-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl]methyl]-1-cycloheptyl-3-(2,6-dimethylphenyl)thiourea CAS Name: 1-[[5-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl]methyl]-1-cycloheptyl-3-(2,6-dimethylphenyl)thiourea IUPAC Name: 1-[[5-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl]methyl]-1-cycloheptyl-3-(2,6-dimethylphenyl)thiourea Traditional Name: 1-[[5-(2-chlorobenzyl)-1H-pyrrol-2-yl]methyl]-1-cycloheptyl-3-(2,6-dimethylphenyl)thiourea Formula: C28H34ClN3S MolecularWeight: 480.10766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H34ClN3S/c1-20-10-9-11-21(2)27(20)31-28(33)32(25-13-5-3-4-6-14-25)19-24-17-16-23(30-24)18-22-12-7-8-15-26(22)29/h7-12,15-17,25,30H,3-6,13-14,18-19H2,1-2H3,(H,31,33)