dimethyl-[3-[4-oxidanylidene-2-[2-oxidanylidene-2-(propylcarbamoylamino)ethyl]sulfanyl-quinazolin-3-yl]propyl]azanium

Systemtic Name: dimethyl-[3-[4-oxidanylidene-2-[2-oxidanylidene-2-(propylcarbamoylamino)ethyl]sulfanyl-quinazolin-3-yl]propyl]azanium Openeye Name: dimethyl-[3-[4-oxo-2-[2-oxo-2-(propylcarbamoylamino)ethyl]sulfanyl-quinazolin-3-yl]propyl]ammonium CAS Name: dimethyl-[3-[4-oxo-2-[[2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl]thio]-3-quinazolinyl]propyl]ammonium IUPAC Name: dimethyl-[3-[4-oxo-2-[2-oxo-2-(propylcarbamoylamino)ethyl]sulfanylquinazolin-3-yl]propyl]azanium Traditional Name: 3-[4-keto-2-[[2-keto-2-(propylcarbamoylamino)ethyl]thio]quinazolin-3-yl]propyl-dimethyl-ammonium Formula: C19H28N5O3S+ MolecularWeight: 406.52232

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCC[NH+](C)C

Isomeric SMILES

CCCNC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCC[NH+](C)C

InChI

InChI=1S/C19H27N5O3S/c1-4-10-20-18(27)22-16(25)13-28-19-21-15-9-6-5-8-14(15)17(26)24(19)12-7-11-23(2)3/h5-6,8-9H,4,7,10-13H2,1-3H3,(H2,20,22,25,27)/p+1