4-(3-methylphenyl)-3-[(4-methylsulfanylphenyl)methylsulfanyl]-5-(phenylmethyl)-1,2,4-triazole

Systemtic Name: 4-(3-methylphenyl)-3-[(4-methylsulfanylphenyl)methylsulfanyl]-5-(phenylmethyl)-1,2,4-triazole Openeye Name: 3-benzyl-5-[(4-methylsulfanylphenyl)methylsulfanyl]-4-(m-tolyl)-1,2,4-triazole CAS Name: 4-(3-methylphenyl)-3-[[4-(methylthio)phenyl]methylthio]-5-(phenylmethyl)-1,2,4-triazole IUPAC Name: 3-benzyl-4-(3-methylphenyl)-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-benzyl-5-[[4-(methylthio)benzyl]thio]-4-(m-tolyl)-1,2,4-triazole Formula: C24H23N3S2 MolecularWeight: 417.58952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SCC3=CC=C(C=C3)SC)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SCC3=CC=C(C=C3)SC)CC4=CC=CC=C4

InChI

InChI=1S/C24H23N3S2/c1-18-7-6-10-21(15-18)27-23(16-19-8-4-3-5-9-19)25-26-24(27)29-17-20-11-13-22(28-2)14-12-20/h3-15H,16-17H2,1-2H3