cyclohexyl 3-azanyl-2-pyridin-2-yl-3-sulfanylidene-propanoate hydrochloride

Systemtic Name: cyclohexyl 3-azanyl-2-pyridin-2-yl-3-sulfanylidene-propanoate hydrochloride Openeye Name: cyclohexyl 3-amino-2-(2-pyridyl)-3-thioxo-propanoate hydrochloride CAS Name: 3-amino-2-(2-pyridinyl)-3-sulfanylidenepropanoic acid cyclohexyl ester hydrochloride IUPAC Name: cyclohexyl 3-amino-2-pyridin-2-yl-3-sulfanylidenepropanoate hydrochloride Traditional Name: 3-amino-2-(2-pyridyl)-3-thioxo-propionic acid cyclohexyl ester hydrochloride Formula: C14H19ClN2O2S MolecularWeight: 314.83086

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C(C2=CC=CC=N2)C(=S)N.Cl

Isomeric SMILES

C1CCC(CC1)OC(=O)C(C2=CC=CC=N2)C(=S)N.Cl

InChI

InChI=1S/C14H18N2O2S.ClH/c15-13(19)12(11-8-4-5-9-16-11)14(17)18-10-6-2-1-3-7-10;/h4-5,8-10,12H,1-3,6-7H2,(H2,15,19);1H