(phenylmethyl) 2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CSC2=NN=C(S2)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CSC2=NN=C(S2)N

InChI

InChI=1S/C11H11N3O2S2/c12-10-13-14-11(18-10)17-7-9(15)16-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,12,13)