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

Systemtic Name: methyl 5-[(3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[(3-cyclohexyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[(3-cyclohexyl-4-oxo-2-quinazolinyl)thio]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(3-cyclohexyl-4-oxoquinazolin-2-yl)sulfanylmethyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[(3-cyclohexyl-4-keto-quinazolin-2-yl)thio]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCCC4)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCCC4)C(=O)OC

InChI

InChI=1S/C22H24N2O4S/c1-14-18(21(26)27-2)12-16(28-14)13-29-22-23-19-11-7-6-10-17(19)20(25)24(22)15-8-4-3-5-9-15/h6-7,10-12,15H,3-5,8-9,13H2,1-2H3