1-(4-tert-butylphenyl)-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propan-1-one

Systemtic Name: 1-(4-tert-butylphenyl)-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propan-1-one Openeye Name: 1-(4-tert-butylphenyl)-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propan-1-one CAS Name: 1-(4-tert-butylphenyl)-2-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]-1-propanone IUPAC Name: 1-(4-tert-butylphenyl)-2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propan-1-one Traditional Name: 1-(4-tert-butylphenyl)-2-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]propan-1-one Formula: C16H20N2OS3 MolecularWeight: 352.5378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)C(C)(C)C)SC2=NN=C(S2)SC

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)C(C)(C)C)SC2=NN=C(S2)SC

InChI

InChI=1S/C16H20N2OS3/c1-10(21-15-18-17-14(20-5)22-15)13(19)11-6-8-12(9-7-11)16(2,3)4/h6-10H,1-5H3