dimethyl-[2-[4-oxidanylidene-2-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]sulfanyl-quinazolin-3-yl]ethyl]azanium

Systemtic Name: dimethyl-[2-[4-oxidanylidene-2-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]sulfanyl-quinazolin-3-yl]ethyl]azanium Openeye Name: dimethyl-[2-[4-oxo-2-[2-oxo-2-(2-thienylmethylamino)ethyl]sulfanyl-quinazolin-3-yl]ethyl]ammonium CAS Name: dimethyl-[2-[4-oxo-2-[[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]thio]-3-quinazolinyl]ethyl]ammonium IUPAC Name: dimethyl-[2-[4-oxo-2-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]sulfanylquinazolin-3-yl]ethyl]azanium Traditional Name: 2-[4-keto-2-[[2-keto-2-(2-thenylamino)ethyl]thio]quinazolin-3-yl]ethyl-dimethyl-ammonium Formula: C19H23N4O2S2+ MolecularWeight: 403.54152

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC3=CC=CS3

Isomeric SMILES

C[NH+](C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC3=CC=CS3

InChI

InChI=1S/C19H22N4O2S2/c1-22(2)9-10-23-18(25)15-7-3-4-8-16(15)21-19(23)27-13-17(24)20-12-14-6-5-11-26-14/h3-8,11H,9-10,12-13H2,1-2H3,(H,20,24)/p+1