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

Systemtic Name: methyl 4-methyl-2-[2-(4-methylquinolin-2-yl)sulfanylethanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 4-methyl-2-[[2-[(4-methyl-2-quinolyl)sulfanyl]acetyl]amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[2-[(4-methyl-2-quinolinyl)thio]-1-oxoethyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[[2-(4-methylquinolin-2-yl)sulfanylacetyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[[2-[(4-methyl-2-quinolyl)thio]acetyl]amino]thiazole-5-carboxylic acid methyl ester Formula: C18H17N3O3S2 MolecularWeight: 387.47588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC3=NC(=C(S3)C(=O)OC)C

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC3=NC(=C(S3)C(=O)OC)C

InChI

InChI=1S/C18H17N3O3S2/c1-10-8-15(20-13-7-5-4-6-12(10)13)25-9-14(22)21-18-19-11(2)16(26-18)17(23)24-3/h4-8H,9H2,1-3H3,(H,19,21,22)