2-[[5-[(2-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethyl benzoate

Systemtic Name: 2-[[5-[(2-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethyl benzoate Openeye Name: 2-[[5-(2-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethyl benzoate CAS Name: benzoic acid 2-[[5-(2-methoxyanilino)-1,3,4-thiadiazol-2-yl]thio]ethyl ester IUPAC Name: 2-[[5-(2-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethyl benzoate Traditional Name: benzoic acid 2-[[5-(o-anisidino)-1,3,4-thiadiazol-2-yl]thio]ethyl ester Formula: C18H17N3O3S2 MolecularWeight: 387.47588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC2=NN=C(S2)SCCOC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1NC2=NN=C(S2)SCCOC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3O3S2/c1-23-15-10-6-5-9-14(15)19-17-20-21-18(26-17)25-12-11-24-16(22)13-7-3-2-4-8-13/h2-10H,11-12H2,1H3,(H,19,20)