ethyl 8-(2-azanylethylsulfanyl)-4-oxidanylidene-3,5-dihydropyrrolo[2,3-c]quinoline-1-carboxylate hydrochloride

Systemtic Name: ethyl 8-(2-azanylethylsulfanyl)-4-oxidanylidene-3,5-dihydropyrrolo[2,3-c]quinoline-1-carboxylate hydrochloride Openeye Name: ethyl 8-(2-aminoethylsulfanyl)-4-oxo-3,5-dihydropyrrolo[2,3-c]quinoline-1-carboxylate hydrochloride CAS Name: 8-(2-aminoethylthio)-4-oxo-3,5-dihydropyrrolo[2,3-c]quinoline-1-carboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 8-(2-aminoethylsulfanyl)-4-oxo-3,5-dihydropyrrolo[2,3-c]quinoline-1-carboxylate hydrochloride Traditional Name: 8-(2-aminoethylthio)-4-keto-3,5-dihydropyrrolo[2,3-c]quinoline-1-carboxylic acid ethyl ester hydrochloride Formula: C16H18ClN3O3S MolecularWeight: 367.85042

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=C1C3=C(C=CC(=C3)SCCN)NC2=O.Cl

Isomeric SMILES

CCOC(=O)C1=CNC2=C1C3=C(C=CC(=C3)SCCN)NC2=O.Cl

InChI

InChI=1S/C16H17N3O3S.ClH/c1-2-22-16(21)11-8-18-14-13(11)10-7-9(23-6-5-17)3-4-12(10)19-15(14)20;/h3-4,7-8,18H,2,5-6,17H2,1H3,(H,19,20);1H