methyl 3-cyclohexyl-2-[4-ethoxy-2,4-bis(oxidanylidene)butyl]sulfanyl-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 3-cyclohexyl-2-[4-ethoxy-2,4-bis(oxidanylidene)butyl]sulfanyl-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 3-cyclohexyl-2-(4-ethoxy-2,4-dioxo-butyl)sulfanyl-4-oxo-quinazoline-7-carboxylate CAS Name: 3-cyclohexyl-2-[(4-ethoxy-2,4-dioxobutyl)thio]-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-cyclohexyl-2-(4-ethoxy-2,4-dioxobutyl)sulfanyl-4-oxoquinazoline-7-carboxylate Traditional Name: 3-cyclohexyl-2-[(4-ethoxy-2,4-diketo-butyl)thio]-4-keto-quinazoline-7-carboxylic acid methyl ester Formula: C22H26N2O6S MolecularWeight: 446.51664

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CSC1=NC2=C(C=CC(=C2)C(=O)OC)C(=O)N1C3CCCCC3

Isomeric SMILES

CCOC(=O)CC(=O)CSC1=NC2=C(C=CC(=C2)C(=O)OC)C(=O)N1C3CCCCC3

InChI

InChI=1S/C22H26N2O6S/c1-3-30-19(26)12-16(25)13-31-22-23-18-11-14(21(28)29-2)9-10-17(18)20(27)24(22)15-7-5-4-6-8-15/h9-11,15H,3-8,12-13H2,1-2H3