methyl 2-[2-[(2-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[2-[(2-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 2-[2-(2-chloroanilino)-2-oxo-ethyl]sulfanyl-3-(2-methoxyethyl)-4-oxo-quinazoline-7-carboxylate CAS Name: 2-[[2-(2-chloroanilino)-2-oxoethyl]thio]-3-(2-methoxyethyl)-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-(2-chloroanilino)-2-oxoethyl]sulfanyl-3-(2-methoxyethyl)-4-oxoquinazoline-7-carboxylate Traditional Name: 2-[[2-(2-chloroanilino)-2-keto-ethyl]thio]-4-keto-3-(2-methoxyethyl)quinazoline-7-carboxylic acid methyl ester Formula: C21H20ClN3O5S MolecularWeight: 461.9186

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC(=O)NC3=CC=CC=C3Cl

Isomeric SMILES

COCCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC(=O)NC3=CC=CC=C3Cl

InChI

InChI=1S/C21H20ClN3O5S/c1-29-10-9-25-19(27)14-8-7-13(20(28)30-2)11-17(14)24-21(25)31-12-18(26)23-16-6-4-3-5-15(16)22/h3-8,11H,9-10,12H2,1-2H3,(H,23,26)