methyl 2-[2-[2-(1,2-diphenylethylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[2-(1,2-diphenylethylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[2-[2-(1,2-diphenylethylamino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]acetate CAS Name: 2-[2-[[2-(1,2-diphenylethylamino)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-(1,2-diphenylethylamino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]acetate Traditional Name: 2-[2-[[2-(1,2-diphenylethylamino)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]acetic acid methyl ester Formula: C27H25N3O4S MolecularWeight: 487.5701

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H25N3O4S/c1-34-25(32)17-30-26(33)21-14-8-9-15-22(21)29-27(30)35-18-24(31)28-23(20-12-6-3-7-13-20)16-19-10-4-2-5-11-19/h2-15,23H,16-18H2,1H3,(H,28,31)