1-(3-imidazol-1-ylpropyl)-1-[(2-methylphenyl)methyl]-3-(4-phenylphenyl)thiourea

Systemtic Name: 1-(3-imidazol-1-ylpropyl)-1-[(2-methylphenyl)methyl]-3-(4-phenylphenyl)thiourea Openeye Name: 1-(3-imidazol-1-ylpropyl)-1-(o-tolylmethyl)-3-(4-phenylphenyl)thiourea CAS Name: 1-[3-(1-imidazolyl)propyl]-1-[(2-methylphenyl)methyl]-3-(4-phenylphenyl)thiourea IUPAC Name: 1-(3-imidazol-1-ylpropyl)-1-[(2-methylphenyl)methyl]-3-(4-phenylphenyl)thiourea Traditional Name: 1-(3-imidazol-1-ylpropyl)-1-(2-methylbenzyl)-3-(4-phenylphenyl)thiourea Formula: C27H28N4S MolecularWeight: 440.60302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CCCN2C=CN=C2)C(=S)NC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CN(CCCN2C=CN=C2)C(=S)NC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H28N4S/c1-22-8-5-6-11-25(22)20-31(18-7-17-30-19-16-28-21-30)27(32)29-26-14-12-24(13-15-26)23-9-3-2-4-10-23/h2-6,8-16,19,21H,7,17-18,20H2,1H3,(H,29,32)