diethyl-[3-[2-[(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]propyl]azanium

Systemtic Name: diethyl-[3-[2-[(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]propyl]azanium Openeye Name: diethyl-[3-[2-[(1S)-2-(ethylcarbamoylamino)-1-methyl-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]propyl]ammonium CAS Name: diethyl-[3-[2-[[(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl]thio]-4-oxo-3-quinazolinyl]propyl]ammonium IUPAC Name: diethyl-[3-[2-[(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl]sulfanyl-4-oxoquinazolin-3-yl]propyl]azanium Traditional Name: diethyl-[3-[2-[[(1S)-2-(ethylcarbamoylamino)-2-keto-1-methyl-ethyl]thio]-4-keto-quinazolin-3-yl]propyl]ammonium Formula: C21H32N5O3S+ MolecularWeight: 434.57548

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)SC1=NC2=CC=CC=C2C(=O)N1CCC[NH+](CC)CC

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C)SC1=NC2=CC=CC=C2C(=O)N1CCC[NH+](CC)CC

InChI

InChI=1S/C21H31N5O3S/c1-5-22-20(29)24-18(27)15(4)30-21-23-17-12-9-8-11-16(17)19(28)26(21)14-10-13-25(6-2)7-3/h8-9,11-12,15H,5-7,10,13-14H2,1-4H3,(H2,22,24,27,29)/p+1/t15-/m0/s1