methyl 3-butyl-4-oxidanylidene-2-(2-oxidanylidene-2-thiophen-2-yl-ethyl)sulfanyl-quinazoline-7-carboxylate

Systemtic Name: methyl 3-butyl-4-oxidanylidene-2-(2-oxidanylidene-2-thiophen-2-yl-ethyl)sulfanyl-quinazoline-7-carboxylate Openeye Name: methyl 3-butyl-4-oxo-2-[2-oxo-2-(2-thienyl)ethyl]sulfanyl-quinazoline-7-carboxylate CAS Name: 3-butyl-4-oxo-2-[(2-oxo-2-thiophen-2-ylethyl)thio]-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-butyl-4-oxo-2-(2-oxo-2-thiophen-2-ylethyl)sulfanylquinazoline-7-carboxylate Traditional Name: 3-butyl-4-keto-2-[[2-keto-2-(2-thienyl)ethyl]thio]quinazoline-7-carboxylic acid methyl ester Formula: C20H20N2O4S2 MolecularWeight: 416.5138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC(=O)C3=CC=CS3

Isomeric SMILES

CCCCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC(=O)C3=CC=CS3

InChI

InChI=1S/C20H20N2O4S2/c1-3-4-9-22-18(24)14-8-7-13(19(25)26-2)11-15(14)21-20(22)28-12-16(23)17-6-5-10-27-17/h5-8,10-11H,3-4,9,12H2,1-2H3