1-[3,4-bis(oxidanyl)phenyl]-2-[[5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-[[5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Openeye Name: 1-(3,4-dihydroxyphenyl)-2-[[5-(3-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone CAS Name: 1-(3,4-dihydroxyphenyl)-2-[[5-(3-methoxyanilino)-1,3,4-thiadiazol-2-yl]thio]ethanone IUPAC Name: 1-(3,4-dihydroxyphenyl)-2-[[5-(3-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Traditional Name: 1-(3,4-dihydroxyphenyl)-2-[[5-(m-anisidino)-1,3,4-thiadiazol-2-yl]thio]ethanone Formula: C17H15N3O4S2 MolecularWeight: 389.4487

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NN=C(S2)SCC(=O)C3=CC(=C(C=C3)O)O

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NN=C(S2)SCC(=O)C3=CC(=C(C=C3)O)O

InChI

InChI=1S/C17H15N3O4S2/c1-24-12-4-2-3-11(8-12)18-16-19-20-17(26-16)25-9-15(23)10-5-6-13(21)14(22)7-10/h2-8,21-22H,9H2,1H3,(H,18,19)