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

Systemtic Name: diethyl-[3-[2-[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]propyl]azanium Openeye Name: diethyl-[3-[2-[2-(o-tolylmethylamino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]propyl]ammonium CAS Name: diethyl-[3-[2-[[2-[(2-methylphenyl)methylamino]-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]propyl]ammonium IUPAC Name: diethyl-[3-[2-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]propyl]azanium Traditional Name: diethyl-[3-[4-keto-2-[[2-keto-2-[(2-methylbenzyl)amino]ethyl]thio]quinazolin-3-yl]propyl]ammonium Formula: C25H33N4O2S+ MolecularWeight: 453.62012

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC3=CC=CC=C3C

Isomeric SMILES

CC[NH+](CC)CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC3=CC=CC=C3C

InChI

InChI=1S/C25H32N4O2S/c1-4-28(5-2)15-10-16-29-24(31)21-13-8-9-14-22(21)27-25(29)32-18-23(30)26-17-20-12-7-6-11-19(20)3/h6-9,11-14H,4-5,10,15-18H2,1-3H3,(H,26,30)/p+1