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

Systemtic Name: 1-(4-bromophenyl)-2-[[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Openeye Name: 1-(4-bromophenyl)-2-[[5-(1-naphthylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone CAS Name: 1-(4-bromophenyl)-2-[[5-(1-naphthalenylmethylthio)-1,3,4-thiadiazol-2-yl]thio]ethanone IUPAC Name: 1-(4-bromophenyl)-2-[[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Traditional Name: 1-(4-bromophenyl)-2-[[5-(1-naphthylmethylthio)-1,3,4-thiadiazol-2-yl]thio]ethanone Formula: C21H15BrN2OS3 MolecularWeight: 487.4556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CSC3=NN=C(S3)SCC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CSC3=NN=C(S3)SCC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H15BrN2OS3/c22-17-10-8-15(9-11-17)19(25)13-27-21-24-23-20(28-21)26-12-16-6-3-5-14-4-1-2-7-18(14)16/h1-11H,12-13H2