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

Systemtic Name: methyl 5-[(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanylmethyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4)C(=O)OC

InChI

InChI=1S/C21H22N2O4S/c1-13-17(20(25)26-2)11-15(27-13)12-28-21-22-18-10-6-5-9-16(18)19(24)23(21)14-7-3-4-8-14/h5-6,9-11,14H,3-4,7-8,12H2,1-2H3