N-[4-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]-1,2,5-oxadiazol-3-yl]-4-bromanyl-benzamide

Systemtic Name: N-[4-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]-1,2,5-oxadiazol-3-yl]-4-bromanyl-benzamide Openeye Name: N-[4-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]-1,2,5-oxadiazol-3-yl]-4-bromo-benzamide CAS Name: N-[4-[[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]amino]-1,2,5-oxadiazol-3-yl]-4-bromobenzamide IUPAC Name: N-[4-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]-1,2,5-oxadiazol-3-yl]-4-bromobenzamide Traditional Name: N-[4-[[2-(1,3-benzothiazol-2-ylthio)acetyl]amino]furazan-3-yl]-4-bromo-benzamide Formula: C18H12BrN5O3S2 MolecularWeight: 490.35358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NC3=NON=C3NC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NC3=NON=C3NC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C18H12BrN5O3S2/c19-11-7-5-10(6-8-11)17(26)22-16-15(23-27-24-16)21-14(25)9-28-18-20-12-3-1-2-4-13(12)29-18/h1-8H,9H2,(H,21,23,25)(H,22,24,26)