ethyl 4-[[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 4-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[oxo-[[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]amino]methyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[5-(benzylthio)-1,3,4-thiadiazol-2-yl]carbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C18H22N4O3S2 MolecularWeight: 406.52228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3

InChI

InChI=1S/C18H22N4O3S2/c1-2-25-18(24)22-10-8-14(9-11-22)15(23)19-16-20-21-17(27-16)26-12-13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3,(H,19,20,23)