ethyl 4-methyl-5-(methylcarbamoyl)-2-[2-(4-methylquinolin-2-yl)sulfanylethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[2-(4-methylquinolin-2-yl)sulfanylethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[[2-[(4-methyl-2-quinolyl)sulfanyl]acetyl]amino]thiophene-3-carboxylate CAS Name: 4-methyl-5-(methylcarbamoyl)-2-[[2-[(4-methyl-2-quinolinyl)thio]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[[2-(4-methylquinolin-2-yl)sulfanylacetyl]amino]thiophene-3-carboxylate Traditional Name: 4-methyl-5-(methylcarbamoyl)-2-[[2-[(4-methyl-2-quinolyl)thio]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H23N3O4S2 MolecularWeight: 457.56572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)CSC2=NC3=CC=CC=C3C(=C2)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)CSC2=NC3=CC=CC=C3C(=C2)C

InChI

InChI=1S/C22H23N3O4S2/c1-5-29-22(28)18-13(3)19(20(27)23-4)31-21(18)25-16(26)11-30-17-10-12(2)14-8-6-7-9-15(14)24-17/h6-10H,5,11H2,1-4H3,(H,23,27)(H,25,26)