1-[(1-methylimidazol-2-yl)-phenyl-methyl]-3-[2-[(4-methylphenyl)methylsulfanyl]ethyl]urea

Systemtic Name: 1-[(1-methylimidazol-2-yl)-phenyl-methyl]-3-[2-[(4-methylphenyl)methylsulfanyl]ethyl]urea Openeye Name: 1-[(1-methylimidazol-2-yl)-phenyl-methyl]-3-[2-(p-tolylmethylsulfanyl)ethyl]urea CAS Name: 1-[(1-methyl-2-imidazolyl)-phenylmethyl]-3-[2-[(4-methylphenyl)methylthio]ethyl]urea IUPAC Name: 1-[(1-methylimidazol-2-yl)-phenylmethyl]-3-[2-[(4-methylphenyl)methylsulfanyl]ethyl]urea Traditional Name: 1-[2-[(4-methylbenzyl)thio]ethyl]-3-[(1-methylimidazol-2-yl)-phenyl-methyl]urea Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCCNC(=O)NC(C2=CC=CC=C2)C3=NC=CN3C

Isomeric SMILES

CC1=CC=C(C=C1)CSCCNC(=O)NC(C2=CC=CC=C2)C3=NC=CN3C

InChI

InChI=1S/C22H26N4OS/c1-17-8-10-18(11-9-17)16-28-15-13-24-22(27)25-20(19-6-4-3-5-7-19)21-23-12-14-26(21)2/h3-12,14,20H,13,15-16H2,1-2H3,(H2,24,25,27)