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

Systemtic Name: 2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid CAS Name: 2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]thio]acetic acid IUPAC Name: 2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid Traditional Name: 2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]thio]acetic acid Formula: C11H11N3O2S2 MolecularWeight: 281.35394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NN=C(S2)SCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NN=C(S2)SCC(=O)O

InChI

InChI=1S/C11H11N3O2S2/c15-9(16)7-17-11-14-13-10(18-11)12-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,12,13)(H,15,16)