3-(1H-benzimidazol-2-yl)-N-[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]propanamide

Systemtic Name: 3-(1H-benzimidazol-2-yl)-N-[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]propanamide Openeye Name: 3-(1H-benzimidazol-2-yl)-N-[2-[2-(3-thienyl)ethylsulfanyl]-1,3-benzothiazol-6-yl]propanamide CAS Name: 3-(1H-benzimidazol-2-yl)-N-[2-[2-(3-thiophenyl)ethylthio]-1,3-benzothiazol-6-yl]propanamide IUPAC Name: 3-(1H-benzimidazol-2-yl)-N-[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]propanamide Traditional Name: 3-(1H-benzimidazol-2-yl)-N-[2-[2-(3-thienyl)ethylthio]-1,3-benzothiazol-6-yl]propionamide Formula: C23H20N4OS3 MolecularWeight: 464.6261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CCC(=O)NC3=CC4=C(C=C3)N=C(S4)SCCC5=CSC=C5

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CCC(=O)NC3=CC4=C(C=C3)N=C(S4)SCCC5=CSC=C5

InChI

InChI=1S/C23H20N4OS3/c28-22(8-7-21-25-17-3-1-2-4-18(17)26-21)24-16-5-6-19-20(13-16)31-23(27-19)30-12-10-15-9-11-29-14-15/h1-6,9,11,13-14H,7-8,10,12H2,(H,24,28)(H,25,26)