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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N(CCCN2C=CN=C2)CC3=CC=C(C=C3)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N(CCCN2C=CN=C2)CC3=CC=C(C=C3)C

InChI

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