ethyl 2-[(2-methylsulfanylpyridin-3-yl)carbonylamino]-4-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[(2-methylsulfanylpyridin-3-yl)carbonylamino]-4-phenyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(2-methylsulfanylpyridine-3-carbonyl)amino]-4-phenyl-thiazole-5-carboxylate CAS Name: 2-[[[2-(methylthio)-3-pyridinyl]-oxomethyl]amino]-4-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-methylsulfanylpyridine-3-carbonyl)amino]-4-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-(methylthio)nicotinoyl]amino]-4-phenyl-thiazole-5-carboxylic acid ethyl ester Formula: C19H17N3O3S2 MolecularWeight: 399.48658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=C(N=CC=C2)SC)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=C(N=CC=C2)SC)C3=CC=CC=C3

InChI

InChI=1S/C19H17N3O3S2/c1-3-25-18(24)15-14(12-8-5-4-6-9-12)21-19(27-15)22-16(23)13-10-7-11-20-17(13)26-2/h4-11H,3H2,1-2H3,(H,21,22,23)