methyl 2-[(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[(3-methyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[(3-methyl-4-oxo-2-quinazolinyl)thio]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[(3-methyl-4-oxoquinazolin-2-yl)sulfanylmethyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-[[(4-keto-3-methyl-quinazolin-2-yl)thio]methyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C20H16N4O4S MolecularWeight: 408.43044

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2N=C1SCC3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)OC

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2N=C1SCC3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)OC

InChI

InChI=1S/C20H16N4O4S/c1-24-18(26)13-5-3-4-6-14(13)22-20(24)29-10-16-21-15-9-11(19(27)28-2)7-8-12(15)17(25)23-16/h3-9H,10H2,1-2H3,(H,21,23,25)