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

Systemtic Name: diethyl-[2-[4-oxidanylidene-2-[2-oxidanylidene-2-(propylcarbamoylamino)ethyl]sulfanyl-quinazolin-3-yl]ethyl]azanium Openeye Name: diethyl-[2-[4-oxo-2-[2-oxo-2-(propylcarbamoylamino)ethyl]sulfanyl-quinazolin-3-yl]ethyl]ammonium CAS Name: diethyl-[2-[4-oxo-2-[[2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl]thio]-3-quinazolinyl]ethyl]ammonium IUPAC Name: diethyl-[2-[4-oxo-2-[2-oxo-2-(propylcarbamoylamino)ethyl]sulfanylquinazolin-3-yl]ethyl]azanium Traditional Name: diethyl-[2-[4-keto-2-[[2-keto-2-(propylcarbamoylamino)ethyl]thio]quinazolin-3-yl]ethyl]ammonium Formula: C20H30N5O3S+ MolecularWeight: 420.5489

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC[NH+](CC)CC

Isomeric SMILES

CCCNC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC[NH+](CC)CC

InChI

InChI=1S/C20H29N5O3S/c1-4-11-21-19(28)23-17(26)14-29-20-22-16-10-8-7-9-15(16)18(27)25(20)13-12-24(5-2)6-3/h7-10H,4-6,11-14H2,1-3H3,(H2,21,23,26,28)/p+1