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

Systemtic Name: 2-[[5-[(3-propan-2-ylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[5-(3-isopropylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid CAS Name: 2-[[5-(3-propan-2-ylanilino)-1,3,4-thiadiazol-2-yl]thio]acetic acid IUPAC Name: 2-[[5-(3-propan-2-ylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid Traditional Name: 2-[[5-(3-isopropylanilino)-1,3,4-thiadiazol-2-yl]thio]acetic acid Formula: C13H15N3O2S2 MolecularWeight: 309.4071

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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