1-[1-[4-(4-methylphenyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]ethyl]-3-(4-methylsulfanylphenyl)urea

Systemtic Name: 1-[1-[4-(4-methylphenyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]ethyl]-3-(4-methylsulfanylphenyl)urea Openeye Name: 1-[1-[5-benzylsulfanyl-4-(p-tolyl)-1,2,4-triazol-3-yl]ethyl]-3-(4-methylsulfanylphenyl)urea CAS Name: 1-[1-[4-(4-methylphenyl)-5-(phenylmethylthio)-1,2,4-triazol-3-yl]ethyl]-3-[4-(methylthio)phenyl]urea IUPAC Name: 1-[1-[5-benzylsulfanyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]ethyl]-3-(4-methylsulfanylphenyl)urea Traditional Name: 1-[1-[5-(benzylthio)-4-(p-tolyl)-1,2,4-triazol-3-yl]ethyl]-3-[4-(methylthio)phenyl]urea Formula: C26H27N5OS2 MolecularWeight: 489.65548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3)C(C)NC(=O)NC4=CC=C(C=C4)SC

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3)C(C)NC(=O)NC4=CC=C(C=C4)SC

InChI

InChI=1S/C26H27N5OS2/c1-18-9-13-22(14-10-18)31-24(29-30-26(31)34-17-20-7-5-4-6-8-20)19(2)27-25(32)28-21-11-15-23(33-3)16-12-21/h4-16,19H,17H2,1-3H3,(H2,27,28,32)