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

Systemtic Name: 3-(4-chloranyl-3-methyl-phenyl)-1-[(4-dimethylaminophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Openeye Name: 3-(4-chloro-3-methyl-phenyl)-1-[(4-dimethylaminophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea CAS Name: 3-(4-chloro-3-methylphenyl)-1-[(4-dimethylaminophenyl)methyl]-1-[3-(1-imidazolyl)propyl]thiourea IUPAC Name: 3-(4-chloro-3-methylphenyl)-1-[(4-dimethylaminophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Traditional Name: 3-(4-chloro-3-methyl-phenyl)-1-[4-(dimethylamino)benzyl]-1-(3-imidazol-1-ylpropyl)thiourea Formula: C23H28ClN5S MolecularWeight: 442.01992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28ClN5S/c1-18-15-20(7-10-22(18)24)26-23(30)29(13-4-12-28-14-11-25-17-28)16-19-5-8-21(9-6-19)27(2)3/h5-11,14-15,17H,4,12-13,16H2,1-3H3,(H,26,30)