ethyl N-[2-(2-azanyl-3-oxidanyl-propyl)phenyl]carbothioylcarbamate hydrochloride

Systemtic Name: ethyl N-[2-(2-azanyl-3-oxidanyl-propyl)phenyl]carbothioylcarbamate hydrochloride Openeye Name: ethyl N-[2-(2-amino-3-hydroxy-propyl)benzenecarbothioyl]carbamate hydrochloride CAS Name: N-[[2-(2-amino-3-hydroxypropyl)phenyl]-sulfanylidenemethyl]carbamic acid ethyl ester hydrochloride IUPAC Name: ethyl N-[2-(2-amino-3-hydroxypropyl)benzenecarbothioyl]carbamate hydrochloride Traditional Name: N-[2-(2-amino-3-hydroxy-propyl)thiobenzoyl]carbamic acid ethyl ester hydrochloride Formula: C13H19ClN2O3S MolecularWeight: 318.81956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=S)C1=CC=CC=C1CC(CO)N.Cl

Isomeric SMILES

CCOC(=O)NC(=S)C1=CC=CC=C1CC(CO)N.Cl

InChI

InChI=1S/C13H18N2O3S.ClH/c1-2-18-13(17)15-12(19)11-6-4-3-5-9(11)7-10(14)8-16;/h3-6,10,16H,2,7-8,14H2,1H3,(H,15,17,19);1H