4-[2-[(4-methyl-5-naphthalen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]benzenecarbonitrile

Systemtic Name: 4-[2-[(4-methyl-5-naphthalen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]benzenecarbonitrile Openeye Name: 4-[2-[[4-methyl-5-(2-naphthyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]benzonitrile CAS Name: 4-[2-[[4-methyl-5-(2-naphthalenyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]benzonitrile IUPAC Name: 4-[2-[(4-methyl-5-naphthalen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]benzonitrile Traditional Name: 4-[2-[[4-methyl-5-(2-naphthyl)-1,2,4-triazol-3-yl]thio]acetyl]benzonitrile Formula: C22H16N4OS MolecularWeight: 384.45364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C#N)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C#N)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H16N4OS/c1-26-21(19-11-10-16-4-2-3-5-18(16)12-19)24-25-22(26)28-14-20(27)17-8-6-15(13-23)7-9-17/h2-12H,14H2,1H3