3-(4-chloranyl-2-methyl-phenyl)-1-[(2,3-dimethoxyphenyl)methyl]-1-(phenylmethyl)thiourea

Systemtic Name: 3-(4-chloranyl-2-methyl-phenyl)-1-[(2,3-dimethoxyphenyl)methyl]-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(4-chloro-2-methyl-phenyl)-1-[(2,3-dimethoxyphenyl)methyl]thiourea CAS Name: 3-(4-chloro-2-methylphenyl)-1-[(2,3-dimethoxyphenyl)methyl]-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(4-chloro-2-methylphenyl)-1-[(2,3-dimethoxyphenyl)methyl]thiourea Traditional Name: 1-benzyl-3-(4-chloro-2-methyl-phenyl)-1-o-veratryl-thiourea Formula: C24H25ClN2O2S MolecularWeight: 440.9855

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC(=S)N(CC2=CC=CC=C2)CC3=C(C(=CC=C3)OC)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC(=S)N(CC2=CC=CC=C2)CC3=C(C(=CC=C3)OC)OC

InChI

InChI=1S/C24H25ClN2O2S/c1-17-14-20(25)12-13-21(17)26-24(30)27(15-18-8-5-4-6-9-18)16-19-10-7-11-22(28-2)23(19)29-3/h4-14H,15-16H2,1-3H3,(H,26,30)