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

Systemtic Name: 2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-oxazole-4-carboxylate Openeye Name: 2-[[4-phenyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanylmethyl]oxazole-4-carboxylate CAS Name: 2-[[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]methyl]-4-oxazolecarboxylate IUPAC Name: 2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-oxazole-4-carboxylate Traditional Name: 2-[[[4-phenyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]methyl]oxazole-4-carboxylate Formula: C17H11N4O3S2- MolecularWeight: 383.42424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC3=NC(=CO3)C(=O)[O-])C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC3=NC(=CO3)C(=O)[O-])C4=CC=CS4

InChI

InChI=1S/C17H12N4O3S2/c22-16(23)12-9-24-14(18-12)10-26-17-20-19-15(13-7-4-8-25-13)21(17)11-5-2-1-3-6-11/h1-9H,10H2,(H,22,23)/p-1