1-[(3S)-3-methylpiperidin-1-yl]-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone

Systemtic Name: 1-[(3S)-3-methylpiperidin-1-yl]-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone Openeye Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-[(3S)-3-methyl-1-piperidyl]ethanone CAS Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-1-[(3S)-3-methyl-1-piperidinyl]ethanone IUPAC Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-[(3S)-3-methylpiperidin-1-yl]ethanone Traditional Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-1-[(3S)-3-methylpiperidino]ethanone Formula: C16H20N4OS2 MolecularWeight: 348.4862

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CSC2=NN=C(S2)NC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)CSC2=NN=C(S2)NC3=CC=CC=C3

InChI

InChI=1S/C16H20N4OS2/c1-12-6-5-9-20(10-12)14(21)11-22-16-19-18-15(23-16)17-13-7-3-2-4-8-13/h2-4,7-8,12H,5-6,9-11H2,1H3,(H,17,18)/t12-/m0/s1