dimethyl-[2-[[2-(phenylmethylsulfanyl)quinazolin-4-yl]amino]ethyl]azanium

Systemtic Name: dimethyl-[2-[[2-(phenylmethylsulfanyl)quinazolin-4-yl]amino]ethyl]azanium Openeye Name: 2-[(2-benzylsulfanylquinazolin-4-yl)amino]ethyl-dimethyl-ammonium CAS Name: dimethyl-[2-[[2-(phenylmethylthio)-4-quinazolinyl]amino]ethyl]ammonium IUPAC Name: 2-[(2-benzylsulfanylquinazolin-4-yl)amino]ethyl-dimethylazanium Traditional Name: 2-[[2-(benzylthio)quinazolin-4-yl]amino]ethyl-dimethyl-ammonium Formula: C19H23N4S+ MolecularWeight: 339.47772

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC1=NC(=NC2=CC=CC=C21)SCC3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CCNC1=NC(=NC2=CC=CC=C21)SCC3=CC=CC=C3

InChI

InChI=1S/C19H22N4S/c1-23(2)13-12-20-18-16-10-6-7-11-17(16)21-19(22-18)24-14-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3,(H,20,21,22)/p+1