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

Systemtic Name: diethyl-[2-[4-oxidanylidene-2-[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]sulfanyl-quinazolin-3-yl]ethyl]azanium Openeye Name: diethyl-[2-[4-oxo-2-[2-oxo-2-(prop-2-ynylamino)ethyl]sulfanyl-quinazolin-3-yl]ethyl]ammonium CAS Name: diethyl-[2-[4-oxo-2-[[2-oxo-2-(prop-2-ynylamino)ethyl]thio]-3-quinazolinyl]ethyl]ammonium IUPAC Name: diethyl-[2-[4-oxo-2-[2-oxo-2-(prop-2-ynylamino)ethyl]sulfanylquinazolin-3-yl]ethyl]azanium Traditional Name: diethyl-[2-[4-keto-2-[[2-keto-2-(propargylamino)ethyl]thio]quinazolin-3-yl]ethyl]ammonium Formula: C19H25N4O2S+ MolecularWeight: 373.4924

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC#C

Isomeric SMILES

CC[NH+](CC)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC#C

InChI

InChI=1S/C19H24N4O2S/c1-4-11-20-17(24)14-26-19-21-16-10-8-7-9-15(16)18(25)23(19)13-12-22(5-2)6-3/h1,7-10H,5-6,11-14H2,2-3H3,(H,20,24)/p+1