2-bromanyl-N-[1-[4-ethyl-5-(3-oxidanylidene-3-phenylazanyl-propyl)sulfanyl-1,2,4-triazol-3-yl]ethyl]benzamide

Systemtic Name: 2-bromanyl-N-[1-[4-ethyl-5-(3-oxidanylidene-3-phenylazanyl-propyl)sulfanyl-1,2,4-triazol-3-yl]ethyl]benzamide Openeye Name: N-[1-[5-(3-anilino-3-oxo-propyl)sulfanyl-4-ethyl-1,2,4-triazol-3-yl]ethyl]-2-bromo-benzamide CAS Name: N-[1-[5-[(3-anilino-3-oxopropyl)thio]-4-ethyl-1,2,4-triazol-3-yl]ethyl]-2-bromobenzamide IUPAC Name: N-[1-[5-(3-anilino-3-oxopropyl)sulfanyl-4-ethyl-1,2,4-triazol-3-yl]ethyl]-2-bromobenzamide Traditional Name: N-[1-[5-[(3-anilino-3-keto-propyl)thio]-4-ethyl-1,2,4-triazol-3-yl]ethyl]-2-bromo-benzamide Formula: C22H24BrN5O2S MolecularWeight: 502.42726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCC(=O)NC2=CC=CC=C2)C(C)NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

CCN1C(=NN=C1SCCC(=O)NC2=CC=CC=C2)C(C)NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C22H24BrN5O2S/c1-3-28-20(15(2)24-21(30)17-11-7-8-12-18(17)23)26-27-22(28)31-14-13-19(29)25-16-9-5-4-6-10-16/h4-12,15H,3,13-14H2,1-2H3,(H,24,30)(H,25,29)