ethyl 4-[5-(pyridin-2-ylmethyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[5-(pyridin-2-ylmethyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[5-(2-pyridylmethyl)-6-thioxo-1,3,5-thiadiazinan-3-yl]piperidine-1-carboxylate CAS Name: 4-[5-(2-pyridinylmethyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-(pyridin-2-ylmethyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]piperidine-1-carboxylate Traditional Name: 4-[5-(2-pyridylmethyl)-6-thioxo-1,3,5-thiadiazinan-3-yl]piperidine-1-carboxylic acid ethyl ester Formula: C17H24N4O2S2 MolecularWeight: 380.52806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2CN(C(=S)SC2)CC3=CC=CC=N3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2CN(C(=S)SC2)CC3=CC=CC=N3

InChI

InChI=1S/C17H24N4O2S2/c1-2-23-16(22)19-9-6-15(7-10-19)21-12-20(17(24)25-13-21)11-14-5-3-4-8-18-14/h3-5,8,15H,2,6-7,9-13H2,1H3