1-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-3,3-dimethyl-butan-2-one

Systemtic Name: 1-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-3,3-dimethyl-butan-2-one Openeye Name: 1-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-3,3-dimethyl-butan-2-one CAS Name: 1-[[5-[(4-methoxyphenyl)methylthio]-1,3,4-thiadiazol-2-yl]thio]-3,3-dimethyl-2-butanone IUPAC Name: 1-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]-3,3-dimethylbutan-2-one Traditional Name: 3,3-dimethyl-1-[[5-(p-anisylthio)-1,3,4-thiadiazol-2-yl]thio]butan-2-one Formula: C16H20N2O2S3 MolecularWeight: 368.5372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NN=C(S1)SCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NN=C(S1)SCC2=CC=C(C=C2)OC

InChI

InChI=1S/C16H20N2O2S3/c1-16(2,3)13(19)10-22-15-18-17-14(23-15)21-9-11-5-7-12(20-4)8-6-11/h5-8H,9-10H2,1-4H3