2-[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-oxazole-4-carboxylate

Systemtic Name: 2-[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-oxazole-4-carboxylate Openeye Name: 2-[[5-methyl-4-(m-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]oxazole-4-carboxylate CAS Name: 2-[[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]-4-oxazolecarboxylate IUPAC Name: 2-[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-oxazole-4-carboxylate Traditional Name: 2-[[[5-methyl-4-(m-tolyl)-1,2,4-triazol-3-yl]thio]methyl]oxazole-4-carboxylate Formula: C15H13N4O3S- MolecularWeight: 329.35372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SCC3=NC(=CO3)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SCC3=NC(=CO3)C(=O)[O-])C

InChI

InChI=1S/C15H14N4O3S/c1-9-4-3-5-11(6-9)19-10(2)17-18-15(19)23-8-13-16-12(7-22-13)14(20)21/h3-7H,8H2,1-2H3,(H,20,21)/p-1