1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Openeye Name: 1-[(2S,6S)-2,6-dimethyl-1-piperidyl]-2-[[4-(o-tolyl)-5-thioxo-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone CAS Name: 1-[(2S,6S)-2,6-dimethyl-1-piperidinyl]-2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]thio]ethanone IUPAC Name: 1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Traditional Name: 1-[(2S,6S)-2,6-dimethylpiperidino]-2-[[4-(o-tolyl)-5-thioxo-1,3,4-thiadiazol-2-yl]thio]ethanone Formula: C18H23N3OS3 MolecularWeight: 393.58972

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)CSC2=NN(C(=S)S2)C3=CC=CC=C3C)C

Isomeric SMILES

C[C@H]1CCC[C@@H](N1C(=O)CSC2=NN(C(=S)S2)C3=CC=CC=C3C)C

InChI

InChI=1S/C18H23N3OS3/c1-12-7-4-5-10-15(12)21-18(23)25-17(19-21)24-11-16(22)20-13(2)8-6-9-14(20)3/h4-5,7,10,13-14H,6,8-9,11H2,1-3H3/t13-,14-/m0/s1