1-(4-methoxyphenyl)-2-[[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-(4-methoxyphenyl)-2-[[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Openeye Name: 1-(4-methoxyphenyl)-2-[[5-(1-naphthylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone CAS Name: 1-(4-methoxyphenyl)-2-[[5-(1-naphthalenylmethylthio)-1,3,4-thiadiazol-2-yl]thio]ethanone IUPAC Name: 1-(4-methoxyphenyl)-2-[[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Traditional Name: 1-(4-methoxyphenyl)-2-[[5-(1-naphthylmethylthio)-1,3,4-thiadiazol-2-yl]thio]ethanone Formula: C22H18N2O2S3 MolecularWeight: 438.58552

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)SCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)SCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H18N2O2S3/c1-26-18-11-9-16(10-12-18)20(25)14-28-22-24-23-21(29-22)27-13-17-7-4-6-15-5-2-3-8-19(15)17/h2-12H,13-14H2,1H3