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

Systemtic Name: diethyl-[2-[2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethyl]azanium Openeye Name: diethyl-[2-[2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]ethyl]ammonium CAS Name: diethyl-[2-[2-[[2-(3-methylanilino)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]ethyl]ammonium IUPAC Name: diethyl-[2-[2-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]ethyl]azanium Traditional Name: diethyl-[2-[4-keto-2-[[2-keto-2-(m-toluidino)ethyl]thio]quinazolin-3-yl]ethyl]ammonium Formula: C23H29N4O2S+ MolecularWeight: 425.56696

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=CC(=C3)C

Isomeric SMILES

CC[NH+](CC)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=CC(=C3)C

InChI

InChI=1S/C23H28N4O2S/c1-4-26(5-2)13-14-27-22(29)19-11-6-7-12-20(19)25-23(27)30-16-21(28)24-18-10-8-9-17(3)15-18/h6-12,15H,4-5,13-14,16H2,1-3H3,(H,24,28)/p+1