ethyl-[(4-methylsulfanylphenyl)methyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium

Systemtic Name: ethyl-[(4-methylsulfanylphenyl)methyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: ethyl-[(4-methylsulfanylphenyl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: ethyl-[[4-(methylthio)phenyl]methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: ethyl-[(4-methylsulfanylphenyl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: ethyl-[(4-keto-1H-quinazolin-2-yl)methyl]-[4-(methylthio)benzyl]ammonium Formula: C19H22N3OS+ MolecularWeight: 340.46248

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=C(C=C1)SC)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC[NH+](CC1=CC=C(C=C1)SC)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C19H21N3OS/c1-3-22(12-14-8-10-15(24-2)11-9-14)13-18-20-17-7-5-4-6-16(17)19(23)21-18/h4-11H,3,12-13H2,1-2H3,(H,20,21,23)/p+1