4-[(3-ethylpiperidin-1-yl)sulfonylmethyl]benzenecarbothioamide

Systemtic Name: 4-[(3-ethylpiperidin-1-yl)sulfonylmethyl]benzenecarbothioamide Openeye Name: 4-[(3-ethyl-1-piperidyl)sulfonylmethyl]benzenecarbothioamide CAS Name: 4-[(3-ethyl-1-piperidinyl)sulfonylmethyl]benzenecarbothioamide IUPAC Name: 4-[(3-ethylpiperidin-1-yl)sulfonylmethyl]benzenecarbothioamide Traditional Name: 4-[(3-ethylpiperidino)sulfonylmethyl]thiobenzamide Formula: C15H22N2O2S2 MolecularWeight: 326.47738

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCN(C1)S(=O)(=O)CC2=CC=C(C=C2)C(=S)N

Isomeric SMILES

CCC1CCCN(C1)S(=O)(=O)CC2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C15H22N2O2S2/c1-2-12-4-3-9-17(10-12)21(18,19)11-13-5-7-14(8-6-13)15(16)20/h5-8,12H,2-4,9-11H2,1H3,(H2,16,20)