3-(4-chloranyl-3-methoxy-phenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methylphenyl)methyl]thiourea

Systemtic Name: 3-(4-chloranyl-3-methoxy-phenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methylphenyl)methyl]thiourea Openeye Name: 3-(4-chloro-3-methoxy-phenyl)-1-(3-imidazol-1-ylpropyl)-1-(o-tolylmethyl)thiourea CAS Name: 3-(4-chloro-3-methoxyphenyl)-1-[3-(1-imidazolyl)propyl]-1-[(2-methylphenyl)methyl]thiourea IUPAC Name: 3-(4-chloro-3-methoxyphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methylphenyl)methyl]thiourea Traditional Name: 3-(4-chloro-3-methoxy-phenyl)-1-(3-imidazol-1-ylpropyl)-1-(2-methylbenzyl)thiourea Formula: C22H25ClN4OS MolecularWeight: 428.9781

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CCCN2C=CN=C2)C(=S)NC3=CC(=C(C=C3)Cl)OC

Isomeric SMILES

CC1=CC=CC=C1CN(CCCN2C=CN=C2)C(=S)NC3=CC(=C(C=C3)Cl)OC

InChI

InChI=1S/C22H25ClN4OS/c1-17-6-3-4-7-18(17)15-27(12-5-11-26-13-10-24-16-26)22(29)25-19-8-9-20(23)21(14-19)28-2/h3-4,6-10,13-14,16H,5,11-12,15H2,1-2H3,(H,25,29)