methyl 5-[[3-(3-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[3-(3-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[[3-(3-methyl-2-pyridyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[3-(3-methyl-2-pyridinyl)-4-oxo-2-quinazolinyl]thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[3-(3-methylpyridin-2-yl)-4-oxoquinazolin-2-yl]sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[[4-keto-3-(3-methyl-2-pyridyl)quinazolin-2-yl]thio]methyl]furan-2-carboxylic acid methyl ester Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(O4)C(=O)OC

Isomeric SMILES

CC1=C(N=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(O4)C(=O)OC

InChI

InChI=1S/C21H17N3O4S/c1-13-6-5-11-22-18(13)24-19(25)15-7-3-4-8-16(15)23-21(24)29-12-14-9-10-17(28-14)20(26)27-2/h3-11H,12H2,1-2H3