3-(2,6-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(4-methylphenyl)methyl]thiourea

Systemtic Name: 3-(2,6-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(4-methylphenyl)methyl]thiourea Openeye Name: 3-(2,6-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-(p-tolylmethyl)thiourea CAS Name: 3-(2,6-dimethylphenyl)-1-[3-(1-imidazolyl)propyl]-1-[(4-methylphenyl)methyl]thiourea IUPAC Name: 3-(2,6-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(4-methylphenyl)methyl]thiourea Traditional Name: 3-(2,6-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-(4-methylbenzyl)thiourea Formula: C23H28N4S MolecularWeight: 392.56022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CCCN2C=CN=C2)C(=S)NC3=C(C=CC=C3C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(CCCN2C=CN=C2)C(=S)NC3=C(C=CC=C3C)C

InChI

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