ethyl 1-[[5-(cyclohexylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[5-(cyclohexylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[5-(cyclohexylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]piperidine-4-carboxylate CAS Name: 1-[[5-(cyclohexylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[5-(cyclohexylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]piperidine-4-carboxylate Traditional Name: 1-[[5-(cyclohexylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]isonipecotic acid ethyl ester Formula: C17H28N4O2S2 MolecularWeight: 384.55982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CN2C(=S)SC(=N2)NC3CCCCC3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CN2C(=S)SC(=N2)NC3CCCCC3

InChI

InChI=1S/C17H28N4O2S2/c1-2-23-15(22)13-8-10-20(11-9-13)12-21-17(24)25-16(19-21)18-14-6-4-3-5-7-14/h13-14H,2-12H2,1H3,(H,18,19)