ethyl 4-[(3-oxidanylpiperidin-1-yl)carbothioylamino]benzoate

Systemtic Name: ethyl 4-[(3-oxidanylpiperidin-1-yl)carbothioylamino]benzoate Openeye Name: ethyl 4-[(3-hydroxypiperidine-1-carbothioyl)amino]benzoate CAS Name: 4-[[(3-hydroxy-1-piperidinyl)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-hydroxypiperidine-1-carbothioyl)amino]benzoate Traditional Name: 4-[(3-hydroxypiperidine-1-carbothioyl)amino]benzoic acid ethyl ester Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)N2CCCC(C2)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)N2CCCC(C2)O

InChI

InChI=1S/C15H20N2O3S/c1-2-20-14(19)11-5-7-12(8-6-11)16-15(21)17-9-3-4-13(18)10-17/h5-8,13,18H,2-4,9-10H2,1H3,(H,16,21)