4-[[4-(2-methoxyphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(2-methoxyphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[5-benzyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile CAS Name: 4-[[[4-(2-methoxyphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]methyl]benzonitrile IUPAC Name: 4-[[5-benzyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile Traditional Name: 4-[[[5-benzyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]methyl]benzonitrile Formula: C24H20N4OS MolecularWeight: 412.5068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=NN=C2SCC3=CC=C(C=C3)C#N)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1N2C(=NN=C2SCC3=CC=C(C=C3)C#N)CC4=CC=CC=C4

InChI

InChI=1S/C24H20N4OS/c1-29-22-10-6-5-9-21(22)28-23(15-18-7-3-2-4-8-18)26-27-24(28)30-17-20-13-11-19(16-25)12-14-20/h2-14H,15,17H2,1H3