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

Systemtic Name: 2-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-oxazole-4-carboxylate Openeye Name: 2-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]oxazole-4-carboxylate CAS Name: 2-[[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]-4-oxazolecarboxylate IUPAC Name: 2-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-oxazole-4-carboxylate Traditional Name: 2-[[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]oxazole-4-carboxylate Formula: C20H15N4O4S- MolecularWeight: 407.4225

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN=C(N2C3=CC=CC=C3)SCC4=NC(=CO4)C(=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN=C(N2C3=CC=CC=C3)SCC4=NC(=CO4)C(=O)[O-]

InChI

InChI=1S/C20H16N4O4S/c1-27-15-9-5-6-13(10-15)18-22-23-20(24(18)14-7-3-2-4-8-14)29-12-17-21-16(11-28-17)19(25)26/h2-11H,12H2,1H3,(H,25,26)/p-1