2-[[2-(2-dimethylaminoethyl)quinazolin-4-yl]amino]-4-methylsulfanyl-butanoic acid hydrochloride

Systemtic Name: 2-[[2-(2-dimethylaminoethyl)quinazolin-4-yl]amino]-4-methylsulfanyl-butanoic acid hydrochloride Openeye Name: 2-[[2-(2-dimethylaminoethyl)quinazolin-4-yl]amino]-4-methylsulfanyl-butanoic acid hydrochloride CAS Name: 2-[[2-(2-dimethylaminoethyl)-4-quinazolinyl]amino]-4-(methylthio)butanoic acid hydrochloride IUPAC Name: 2-[[2-(2-dimethylaminoethyl)quinazolin-4-yl]amino]-4-methylsulfanylbutanoic acid hydrochloride Traditional Name: 2-[[2-(2-dimethylaminoethyl)quinazolin-4-yl]amino]-4-(methylthio)butyric acid hydrochloride Formula: C17H25ClN4O2S MolecularWeight: 384.924

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=NC2=CC=CC=C2C(=N1)NC(CCSC)C(=O)O.Cl

Isomeric SMILES

CN(C)CCC1=NC2=CC=CC=C2C(=N1)NC(CCSC)C(=O)O.Cl

InChI

InChI=1S/C17H24N4O2S.ClH/c1-21(2)10-8-15-18-13-7-5-4-6-12(13)16(20-15)19-14(17(22)23)9-11-24-3;/h4-7,14H,8-11H2,1-3H3,(H,22,23)(H,18,19,20);1H