ethyl 2-[5-[(4-bromophenyl)amino]-1,3,4-thiadiazol-2-yl]ethanoate

Systemtic Name: ethyl 2-[5-[(4-bromophenyl)amino]-1,3,4-thiadiazol-2-yl]ethanoate Openeye Name: ethyl 2-[5-(4-bromoanilino)-1,3,4-thiadiazol-2-yl]acetate CAS Name: 2-[5-(4-bromoanilino)-1,3,4-thiadiazol-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-(4-bromoanilino)-1,3,4-thiadiazol-2-yl]acetate Traditional Name: 2-[5-(4-bromoanilino)-1,3,4-thiadiazol-2-yl]acetic acid ethyl ester Formula: C12H12BrN3O2S MolecularWeight: 342.21158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN=C(S1)NC2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)CC1=NN=C(S1)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C12H12BrN3O2S/c1-2-18-11(17)7-10-15-16-12(19-10)14-9-5-3-8(13)4-6-9/h3-6H,2,7H2,1H3,(H,14,16)