3-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]-N-(4-bromophenyl)propanamide

Systemtic Name: 3-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]-N-(4-bromophenyl)propanamide Openeye Name: 3-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]-N-(4-bromophenyl)propanamide CAS Name: 3-[3-[(1,3-benzothiazol-2-ylthio)methyl]-1,2,4-oxadiazol-5-yl]-N-(4-bromophenyl)propanamide IUPAC Name: 3-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]-N-(4-bromophenyl)propanamide Traditional Name: 3-[3-[(1,3-benzothiazol-2-ylthio)methyl]-1,2,4-oxadiazol-5-yl]-N-(4-bromophenyl)propionamide Formula: C19H15BrN4O2S2 MolecularWeight: 475.382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC3=NOC(=N3)CCC(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC3=NOC(=N3)CCC(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C19H15BrN4O2S2/c20-12-5-7-13(8-6-12)21-17(25)9-10-18-23-16(24-26-18)11-27-19-22-14-3-1-2-4-15(14)28-19/h1-8H,9-11H2,(H,21,25)