S-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl] 2-oxidanylbenzenecarbothioate

Systemtic Name: S-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl] 2-oxidanylbenzenecarbothioate Openeye Name: S-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl] 2-hydroxybenzenecarbothioate CAS Name: 2-hydroxybenzenecarbothioic acid S-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl] ester IUPAC Name: S-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl] 2-hydroxybenzenecarbothioate Traditional Name: 2-hydroxythiobenzoic acid S-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl] ester Formula: C16H12N2O4S MolecularWeight: 328.34248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN=C(O2)SC(=O)C3=CC=CC=C3O

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN=C(O2)SC(=O)C3=CC=CC=C3O

InChI

InChI=1S/C16H12N2O4S/c1-21-11-6-4-5-10(9-11)14-17-18-16(22-14)23-15(20)12-7-2-3-8-13(12)19/h2-9,19H,1H3