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

Systemtic Name: 2-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-1-phenyl-ethanone Openeye Name: 2-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-1-phenyl-ethanone CAS Name: 2-[[5-[(4-methoxyphenyl)methylthio]-1,3,4-thiadiazol-2-yl]thio]-1-phenylethanone IUPAC Name: 2-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-1-phenylethanone Traditional Name: 2-[[5-(p-anisylthio)-1,3,4-thiadiazol-2-yl]thio]-1-phenyl-ethanone Formula: C18H16N2O2S3 MolecularWeight: 388.52684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=NN=C(S2)SCC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=NN=C(S2)SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H16N2O2S3/c1-22-15-9-7-13(8-10-15)11-23-17-19-20-18(25-17)24-12-16(21)14-5-3-2-4-6-14/h2-10H,11-12H2,1H3