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

Systemtic Name: 2-[[5-[(4-propan-2-ylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: 2-[[5-(4-isopropylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(4-propan-2-ylanilino)-1,3,4-thiadiazol-2-yl]thio]acetate IUPAC Name: 2-[[5-(4-propan-2-ylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[(5-cumidino-1,3,4-thiadiazol-2-yl)thio]acetate Formula: C13H14N3O2S2- MolecularWeight: 308.39916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2=NN=C(S2)SCC(=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2=NN=C(S2)SCC(=O)[O-]

InChI

InChI=1S/C13H15N3O2S2/c1-8(2)9-3-5-10(6-4-9)14-12-15-16-13(20-12)19-7-11(17)18/h3-6,8H,7H2,1-2H3,(H,14,15)(H,17,18)/p-1