4-methoxy-3-[[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]oxy]benzoate

Systemtic Name: 4-methoxy-3-[[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]oxy]benzoate Openeye Name: 3-[(3-benzyl-1,2,4-thiadiazol-5-yl)oxy]-4-methoxy-benzoate CAS Name: 4-methoxy-3-[[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]oxy]benzoate IUPAC Name: 3-[(3-benzyl-1,2,4-thiadiazol-5-yl)oxy]-4-methoxybenzoate Traditional Name: 3-[(3-benzyl-1,2,4-thiadiazol-5-yl)oxy]-4-methoxy-benzoate Formula: C17H13N2O4S- MolecularWeight: 341.36112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)[O-])OC2=NC(=NS2)CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)[O-])OC2=NC(=NS2)CC3=CC=CC=C3

InChI

InChI=1S/C17H14N2O4S/c1-22-13-8-7-12(16(20)21)10-14(13)23-17-18-15(19-24-17)9-11-5-3-2-4-6-11/h2-8,10H,9H2,1H3,(H,20,21)/p-1