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

Systemtic Name: 1-[(4-dimethylaminophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(3-methylphenyl)thiourea Openeye Name: 1-[(4-dimethylaminophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(m-tolyl)thiourea CAS Name: 1-[(4-dimethylaminophenyl)methyl]-1-[3-(1-imidazolyl)propyl]-3-(3-methylphenyl)thiourea IUPAC Name: 1-[(4-dimethylaminophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(3-methylphenyl)thiourea Traditional Name: 1-[4-(dimethylamino)benzyl]-1-(3-imidazol-1-ylpropyl)-3-(m-tolyl)thiourea Formula: C23H29N5S MolecularWeight: 407.57486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N5S/c1-19-6-4-7-21(16-19)25-23(29)28(14-5-13-27-15-12-24-18-27)17-20-8-10-22(11-9-20)26(2)3/h4,6-12,15-16,18H,5,13-14,17H2,1-3H3,(H,25,29)