methyl 2-[[5-[(4-ethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: methyl 2-[[5-[(4-ethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: methyl 2-[[5-(4-ethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(4-ethylanilino)-1,3,4-thiadiazol-2-yl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[[5-(4-ethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(4-ethylanilino)-1,3,4-thiadiazol-2-yl]thio]acetic acid methyl ester Formula: C13H15N3O2S2 MolecularWeight: 309.4071

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NN=C(S2)SCC(=O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NN=C(S2)SCC(=O)OC

InChI

InChI=1S/C13H15N3O2S2/c1-3-9-4-6-10(7-5-9)14-12-15-16-13(20-12)19-8-11(17)18-2/h4-7H,3,8H2,1-2H3,(H,14,15)