5-[2-(2-azanylpyridin-4-yl)-3-methoxy-phenyl]-N-(4-bromophenyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[2-(2-azanylpyridin-4-yl)-3-methoxy-phenyl]-N-(4-bromophenyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[2-(2-amino-4-pyridyl)-3-methoxy-phenyl]-N-(4-bromophenyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[2-(2-amino-4-pyridinyl)-3-methoxyphenyl]-N-(4-bromophenyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[2-(2-aminopyridin-4-yl)-3-methoxyphenyl]-N-(4-bromophenyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[2-(2-amino-4-pyridyl)-3-methoxy-phenyl]-1,3,4-thiadiazol-2-yl]-(4-bromophenyl)amine Formula: C20H16BrN5OS MolecularWeight: 454.34294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1C2=CC(=NC=C2)N)C3=NN=C(S3)NC4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=CC(=C1C2=CC(=NC=C2)N)C3=NN=C(S3)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C20H16BrN5OS/c1-27-16-4-2-3-15(18(16)12-9-10-23-17(22)11-12)19-25-26-20(28-19)24-14-7-5-13(21)6-8-14/h2-11H,1H3,(H2,22,23)(H,24,26)