ethyl 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-phenyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-phenyl-thiazole-5-carboxylate CAS Name: 4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]-2-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]-2-phenyl-thiazole-5-carboxylic acid ethyl ester Formula: C16H16N4O2S2 MolecularWeight: 360.45384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)C2=CC=CC=C2)CSC3=NN=CN3C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)C2=CC=CC=C2)CSC3=NN=CN3C

InChI

InChI=1S/C16H16N4O2S2/c1-3-22-15(21)13-12(9-23-16-19-17-10-20(16)2)18-14(24-13)11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3