2-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)ethyl-di(propan-2-yl)azanium Openeye Name: diisopropyl-[2-(4-oxo-2-thioxo-1H-quinazolin-3-yl)ethyl]ammonium CAS Name: 2-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)ethyl-di(propan-2-yl)azanium Traditional Name: diisopropyl-[2-(4-keto-2-thioxo-1H-quinazolin-3-yl)ethyl]ammonium Formula: C16H24N3OS+ MolecularWeight: 306.44626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCN1C(=O)C2=CC=CC=C2NC1=S)C(C)C

Isomeric SMILES

CC(C)[NH+](CCN1C(=O)C2=CC=CC=C2NC1=S)C(C)C

InChI

InChI=1S/C16H23N3OS/c1-11(2)18(12(3)4)9-10-19-15(20)13-7-5-6-8-14(13)17-16(19)21/h5-8,11-12H,9-10H2,1-4H3,(H,17,21)/p+1