2-(2-dimethylaminoethylsulfanyl)-N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]ethanamide hydrochloride

Systemtic Name: 2-(2-dimethylaminoethylsulfanyl)-N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]ethanamide hydrochloride Openeye Name: 2-(2-dimethylaminoethylsulfanyl)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]acetamide hydrochloride CAS Name: 2-(2-dimethylaminoethylthio)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]acetamide hydrochloride IUPAC Name: 2-(2-dimethylaminoethylsulfanyl)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]acetamide hydrochloride Traditional Name: 2-(2-dimethylaminoethylthio)-N-[3-(4-keto-3H-phthalazin-1-yl)phenyl]acetamide hydrochloride Formula: C20H23ClN4O2S MolecularWeight: 418.94022

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSCC(=O)NC1=CC=CC(=C1)C2=NNC(=O)C3=CC=CC=C32.Cl

Isomeric SMILES

CN(C)CCSCC(=O)NC1=CC=CC(=C1)C2=NNC(=O)C3=CC=CC=C32.Cl

InChI

InChI=1S/C20H22N4O2S.ClH/c1-24(2)10-11-27-13-18(25)21-15-7-5-6-14(12-15)19-16-8-3-4-9-17(16)20(26)23-22-19;/h3-9,12H,10-11,13H2,1-2H3,(H,21,25)(H,23,26);1H