diethyl-[[(4-oxidanylidenequinazolin-3-yl)amino]-prop-2-enylsulfanyl-methylidene]azanium

Systemtic Name: diethyl-[[(4-oxidanylidenequinazolin-3-yl)amino]-prop-2-enylsulfanyl-methylidene]azanium Openeye Name: [allylsulfanyl-[(4-oxoquinazolin-3-yl)amino]methylene]-diethyl-ammonium CAS Name: diethyl-[[(4-oxo-3-quinazolinyl)amino]-(prop-2-enylthio)methylidene]ammonium IUPAC Name: diethyl-[[(4-oxoquinazolin-3-yl)amino]-prop-2-enylsulfanylmethylidene]azanium Traditional Name: [(allylthio)-[(4-ketoquinazolin-3-yl)amino]methylene]-diethyl-ammonium Formula: C16H21N4OS+ MolecularWeight: 317.42914

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](=C(NN1C=NC2=CC=CC=C2C1=O)SCC=C)CC

Isomeric SMILES

CC[N+](=C(NN1C=NC2=CC=CC=C2C1=O)SCC=C)CC

InChI

InChI=1S/C16H20N4OS/c1-4-11-22-16(19(5-2)6-3)18-20-12-17-14-10-8-7-9-13(14)15(20)21/h4,7-10,12H,1,5-6,11H2,2-3H3/p+1