ethyl 4-methyl-2-(3-quinolin-2-ylsulfanylpropanoylamino)-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-(3-quinolin-2-ylsulfanylpropanoylamino)-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[3-(2-quinolylsulfanyl)propanoylamino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[1-oxo-3-(2-quinolinylthio)propyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-(3-quinolin-2-ylsulfanylpropanoylamino)-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[3-(2-quinolylthio)propanoylamino]thiazole-5-carboxylic acid ethyl ester Formula: C19H19N3O3S2 MolecularWeight: 401.50246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CCSC2=NC3=CC=CC=C3C=C2)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CCSC2=NC3=CC=CC=C3C=C2)C

InChI

InChI=1S/C19H19N3O3S2/c1-3-25-18(24)17-12(2)20-19(27-17)22-15(23)10-11-26-16-9-8-13-6-4-5-7-14(13)21-16/h4-9H,3,10-11H2,1-2H3,(H,20,22,23)