methyl 2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NN=C(S1)NC2=CC=CC=C2

Isomeric SMILES

COC(=O)CSC1=NN=C(S1)NC2=CC=CC=C2

InChI

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