ethyl 4-methyl-2-[2-(4-methylquinolin-2-yl)sulfanylethanoyl-(phenylmethyl)amino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[2-(4-methylquinolin-2-yl)sulfanylethanoyl-(phenylmethyl)amino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[benzyl-[2-[(4-methyl-2-quinolyl)sulfanyl]acetyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 4-methyl-2-[[2-[(4-methyl-2-quinolinyl)thio]-1-oxoethyl]-(phenylmethyl)amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[benzyl-[2-(4-methylquinolin-2-yl)sulfanylacetyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[benzyl-[2-[(4-methyl-2-quinolyl)thio]acetyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C26H25N3O3S2 MolecularWeight: 491.625

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)N(CC2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4C(=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)N(CC2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4C(=C3)C)C

InChI

InChI=1S/C26H25N3O3S2/c1-4-32-25(31)24-18(3)27-26(34-24)29(15-19-10-6-5-7-11-19)23(30)16-33-22-14-17(2)20-12-8-9-13-21(20)28-22/h5-14H,4,15-16H2,1-3H3