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

Systemtic Name: ethyl 1-[[5-(3-ethoxypropylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[5-(3-ethoxypropylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]piperidine-4-carboxylate CAS Name: 1-[[5-(3-ethoxypropylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[5-(3-ethoxypropylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]piperidine-4-carboxylate Traditional Name: 1-[[5-(3-ethoxypropylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]isonipecotic acid ethyl ester Formula: C16H28N4O3S2 MolecularWeight: 388.54852

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC1=NN(C(=S)S1)CN2CCC(CC2)C(=O)OCC

Isomeric SMILES

CCOCCCNC1=NN(C(=S)S1)CN2CCC(CC2)C(=O)OCC

InChI

InChI=1S/C16H28N4O3S2/c1-3-22-11-5-8-17-15-18-20(16(24)25-15)12-19-9-6-13(7-10-19)14(21)23-4-2/h13H,3-12H2,1-2H3,(H,17,18)