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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SCC3=CC=CC(=C3)C#N)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SCC3=CC=CC(=C3)C#N)C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H20N4OS/c1-17-5-3-8-21(13-17)28-23(20-9-11-22(29-2)12-10-20)26-27-24(28)30-16-19-7-4-6-18(14-19)15-25/h3-14H,16H2,1-2H3