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

Systemtic Name: 3-(2-chloranyl-3-methyl-phenyl)-1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Openeye Name: 3-(2-chloro-3-methyl-phenyl)-1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea CAS Name: 3-(2-chloro-3-methylphenyl)-1-[(2,4-dimethoxyphenyl)methyl]-1-[3-(1-imidazolyl)propyl]thiourea IUPAC Name: 3-(2-chloro-3-methylphenyl)-1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Traditional Name: 3-(2-chloro-3-methyl-phenyl)-1-(2,4-dimethoxybenzyl)-1-(3-imidazol-1-ylpropyl)thiourea Formula: C23H27ClN4O2S MolecularWeight: 459.00408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)N(CCCN2C=CN=C2)CC3=C(C=C(C=C3)OC)OC)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)N(CCCN2C=CN=C2)CC3=C(C=C(C=C3)OC)OC)Cl

InChI

InChI=1S/C23H27ClN4O2S/c1-17-6-4-7-20(22(17)24)26-23(31)28(12-5-11-27-13-10-25-16-27)15-18-8-9-19(29-2)14-21(18)30-3/h4,6-10,13-14,16H,5,11-12,15H2,1-3H3,(H,26,31)