methyl 4,5-dimethyl-2-[2-(3,6,8-trimethylquinolin-2-yl)sulfanylethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4,5-dimethyl-2-[2-(3,6,8-trimethylquinolin-2-yl)sulfanylethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-[[2-[(3,6,8-trimethyl-2-quinolyl)sulfanyl]acetyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[1-oxo-2-[(3,6,8-trimethyl-2-quinolinyl)thio]ethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-[[2-(3,6,8-trimethylquinolin-2-yl)sulfanylacetyl]amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[2-[(3,6,8-trimethyl-2-quinolyl)thio]acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C22H24N2O3S2 MolecularWeight: 428.56756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=C(C(=N2)SCC(=O)NC3=C(C(=C(S3)C)C)C(=O)OC)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C=C(C(=N2)SCC(=O)NC3=C(C(=C(S3)C)C)C(=O)OC)C)C

InChI

InChI=1S/C22H24N2O3S2/c1-11-7-12(2)19-16(8-11)9-13(3)20(24-19)28-10-17(25)23-21-18(22(26)27-6)14(4)15(5)29-21/h7-9H,10H2,1-6H3,(H,23,25)