methyl 2-[2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: methyl 2-[2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: methyl 2-[2-(3-chloro-4-methoxy-anilino)-2-oxo-ethyl]sulfanyl-6-methyl-4-oxo-1H-quinoline-3-carboxylate CAS Name: 2-[[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]thio]-6-methyl-4-oxo-1H-quinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]sulfanyl-6-methyl-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 2-[[2-(3-chloro-4-methoxy-anilino)-2-keto-ethyl]thio]-4-keto-6-methyl-1H-quinoline-3-carboxylic acid methyl ester Formula: C21H19ClN2O5S MolecularWeight: 446.90396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C(C2=O)C(=O)OC)SCC(=O)NC3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C(C2=O)C(=O)OC)SCC(=O)NC3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C21H19ClN2O5S/c1-11-4-6-15-13(8-11)19(26)18(21(27)29-3)20(24-15)30-10-17(25)23-12-5-7-16(28-2)14(22)9-12/h4-9H,10H2,1-3H3,(H,23,25)(H,24,26)