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

Systemtic Name: methyl 5-[[3-[(2S)-butan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 2-methyl-5-[[3-[(1S)-1-methylpropyl]-4-oxo-quinazolin-2-yl]sulfanylmethyl]furan-3-carboxylate CAS Name: 5-[[[3-[(2S)-butan-2-yl]-4-oxo-2-quinazolinyl]thio]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[3-[(2S)-butan-2-yl]-4-oxoquinazolin-2-yl]sulfanylmethyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[[4-keto-3-[(1S)-1-methylpropyl]quinazolin-2-yl]thio]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=C(O3)C)C(=O)OC

Isomeric SMILES

CC[C@H](C)N1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=C(O3)C)C(=O)OC

InChI

InChI=1S/C20H22N2O4S/c1-5-12(2)22-18(23)15-8-6-7-9-17(15)21-20(22)27-11-14-10-16(13(3)26-14)19(24)25-4/h6-10,12H,5,11H2,1-4H3/t12-/m0/s1