2-methylpropyl 2-[2-(4,8-dimethylquinolin-2-yl)sulfanylethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: 2-methylpropyl 2-[2-(4,8-dimethylquinolin-2-yl)sulfanylethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: isobutyl 2-[[2-[(4,8-dimethyl-2-quinolyl)sulfanyl]acetyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-[(4,8-dimethyl-2-quinolinyl)thio]-1-oxoethyl]amino]-4-methyl-5-thiazolecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[[2-(4,8-dimethylquinolin-2-yl)sulfanylacetyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[(4,8-dimethyl-2-quinolyl)thio]acetyl]amino]-4-methyl-thiazole-5-carboxylic acid isobutyl ester Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC3=NC(=C(S3)C(=O)OCC(C)C)C

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC3=NC(=C(S3)C(=O)OCC(C)C)C

InChI

InChI=1S/C22H25N3O3S2/c1-12(2)10-28-21(27)20-15(5)23-22(30-20)24-17(26)11-29-18-9-14(4)16-8-6-7-13(3)19(16)25-18/h6-9,12H,10-11H2,1-5H3,(H,23,24,26)