diethyl-[3-[4-oxidanylidene-2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanyl-quinazolin-3-yl]propyl]azanium

Systemtic Name: diethyl-[3-[4-oxidanylidene-2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanyl-quinazolin-3-yl]propyl]azanium Openeye Name: diethyl-[3-[2-[2-(isopropylamino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]propyl]ammonium CAS Name: diethyl-[3-[4-oxo-2-[[2-oxo-2-(propan-2-ylamino)ethyl]thio]-3-quinazolinyl]propyl]ammonium IUPAC Name: diethyl-[3-[4-oxo-2-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylquinazolin-3-yl]propyl]azanium Traditional Name: diethyl-[3-[2-[[2-(isopropylamino)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]propyl]ammonium Formula: C20H31N4O2S+ MolecularWeight: 391.55074

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(C)C

Isomeric SMILES

CC[NH+](CC)CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(C)C

InChI

InChI=1S/C20H30N4O2S/c1-5-23(6-2)12-9-13-24-19(26)16-10-7-8-11-17(16)22-20(24)27-14-18(25)21-15(3)4/h7-8,10-11,15H,5-6,9,12-14H2,1-4H3,(H,21,25)/p+1