methyl 2-[2-(3-ethyl-7-methyl-quinolin-2-yl)sulfanylethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[2-(3-ethyl-7-methyl-quinolin-2-yl)sulfanylethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[[2-[(3-ethyl-7-methyl-2-quinolyl)sulfanyl]acetyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-[(3-ethyl-7-methyl-2-quinolinyl)thio]-1-oxoethyl]amino]-4-methyl-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(3-ethyl-7-methylquinolin-2-yl)sulfanylacetyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[(3-ethyl-7-methyl-2-quinolyl)thio]acetyl]amino]-4-methyl-thiazole-5-carboxylic acid methyl ester Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C=C(C=CC2=C1)C)SCC(=O)NC3=NC(=C(S3)C(=O)OC)C

Isomeric SMILES

CCC1=C(N=C2C=C(C=CC2=C1)C)SCC(=O)NC3=NC(=C(S3)C(=O)OC)C

InChI

InChI=1S/C20H21N3O3S2/c1-5-13-9-14-7-6-11(2)8-15(14)22-18(13)27-10-16(24)23-20-21-12(3)17(28-20)19(25)26-4/h6-9H,5,10H2,1-4H3,(H,21,23,24)