S-(2-phenylquinolin-4-yl) N,N-diethylcarbamothioate hydrochloride

Systemtic Name: S-(2-phenylquinolin-4-yl) N,N-diethylcarbamothioate hydrochloride Openeye Name: S-[(2-phenyl-4-quinolyl)] N,N-diethylcarbamothioate hydrochloride CAS Name: N,N-diethylcarbamothioic acid S-[(2-phenyl-4-quinolinyl)] ester hydrochloride IUPAC Name: S-(2-phenylquinolin-4-yl) N,N-diethylcarbamothioate hydrochloride Traditional Name: N,N-diethylthiocarbamic acid S-[(2-phenyl-4-quinolyl)] ester hydrochloride Formula: C20H21ClN2OS MolecularWeight: 372.91154

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)SC1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3.Cl

Isomeric SMILES

CCN(CC)C(=O)SC1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3.Cl

InChI

InChI=1S/C20H20N2OS.ClH/c1-3-22(4-2)20(23)24-19-14-18(15-10-6-5-7-11-15)21-17-13-9-8-12-16(17)19;/h5-14H,3-4H2,1-2H3;1H