4-[[5-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methoxy]benzenecarbonitrile

Systemtic Name: 4-[[5-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methoxy]benzenecarbonitrile Openeye Name: 4-[[5-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methoxy]benzonitrile CAS Name: 4-[[5-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-4-phenyl-1,2,4-triazol-3-yl]methoxy]benzonitrile IUPAC Name: 4-[[5-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methoxy]benzonitrile Traditional Name: 4-[[5-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-4-phenyl-1,2,4-triazol-3-yl]methoxy]benzonitrile Formula: C25H20N4O3S MolecularWeight: 456.5163

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)COC4=CC=C(C=C4)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)COC4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H20N4O3S/c1-31-21-13-9-19(10-14-21)23(30)17-33-25-28-27-24(29(25)20-5-3-2-4-6-20)16-32-22-11-7-18(15-26)8-12-22/h2-14H,16-17H2,1H3