1-[(4-dimethylaminophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(3-methoxy-4-methyl-phenyl)thiourea

Systemtic Name: 1-[(4-dimethylaminophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(3-methoxy-4-methyl-phenyl)thiourea Openeye Name: 1-[(4-dimethylaminophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(3-methoxy-4-methyl-phenyl)thiourea CAS Name: 1-[(4-dimethylaminophenyl)methyl]-1-[3-(1-imidazolyl)propyl]-3-(3-methoxy-4-methylphenyl)thiourea IUPAC Name: 1-[(4-dimethylaminophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(3-methoxy-4-methylphenyl)thiourea Traditional Name: 1-[4-(dimethylamino)benzyl]-1-(3-imidazol-1-ylpropyl)-3-(3-methoxy-4-methyl-phenyl)thiourea Formula: C24H31N5OS MolecularWeight: 437.60084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N5OS/c1-19-6-9-21(16-23(19)30-4)26-24(31)29(14-5-13-28-15-12-25-18-28)17-20-7-10-22(11-8-20)27(2)3/h6-12,15-16,18H,5,13-14,17H2,1-4H3,(H,26,31)