3-(2,5-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methylphenyl)methyl]thiourea

Systemtic Name: 3-(2,5-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methylphenyl)methyl]thiourea Openeye Name: 3-(2,5-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-(o-tolylmethyl)thiourea CAS Name: 3-(2,5-dimethylphenyl)-1-[3-(1-imidazolyl)propyl]-1-[(2-methylphenyl)methyl]thiourea IUPAC Name: 3-(2,5-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methylphenyl)methyl]thiourea Traditional Name: 3-(2,5-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-(2-methylbenzyl)thiourea Formula: C23H28N4S MolecularWeight: 392.56022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)N(CCCN2C=CN=C2)CC3=CC=CC=C3C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)N(CCCN2C=CN=C2)CC3=CC=CC=C3C

InChI

InChI=1S/C23H28N4S/c1-18-9-10-20(3)22(15-18)25-23(28)27(13-6-12-26-14-11-24-17-26)16-21-8-5-4-7-19(21)2/h4-5,7-11,14-15,17H,6,12-13,16H2,1-3H3,(H,25,28)