[3-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]phenyl] ethanoate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC(=C1)CSC2=NN=C(S2)N

Isomeric SMILES

CC(=O)OC1=CC=CC(=C1)CSC2=NN=C(S2)N

InChI

InChI=1S/C11H11N3O2S2/c1-7(15)16-9-4-2-3-8(5-9)6-17-11-14-13-10(12)18-11/h2-5H,6H2,1H3,(H2,12,13)