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

Systemtic Name: diethyl-[3-[4-oxidanylidene-2-[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl]sulfanyl-quinazolin-3-yl]propyl]azanium Openeye Name: diethyl-[3-[2-[2-(isopropylcarbamoylamino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]propyl]ammonium CAS Name: diethyl-[3-[4-oxo-2-[[2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl]thio]-3-quinazolinyl]propyl]ammonium IUPAC Name: diethyl-[3-[4-oxo-2-[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl]sulfanylquinazolin-3-yl]propyl]azanium Traditional Name: diethyl-[3-[2-[[2-(isopropylcarbamoylamino)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]propyl]ammonium Formula: C21H32N5O3S+ MolecularWeight: 434.57548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31N5O3S/c1-5-25(6-2)12-9-13-26-19(28)16-10-7-8-11-17(16)23-21(26)30-14-18(27)24-20(29)22-15(3)4/h7-8,10-11,15H,5-6,9,12-14H2,1-4H3,(H2,22,24,27,29)/p+1