N-[6-[bis(fluoranyl)methylsulfanyl]-1,3-benzothiazol-2-yl]-3-phenothiazin-10-yl-propanamide

Systemtic Name: N-[6-[bis(fluoranyl)methylsulfanyl]-1,3-benzothiazol-2-yl]-3-phenothiazin-10-yl-propanamide Openeye Name: N-[6-(difluoromethylsulfanyl)-1,3-benzothiazol-2-yl]-3-phenothiazin-10-yl-propanamide CAS Name: N-[6-(difluoromethylthio)-1,3-benzothiazol-2-yl]-3-(10-phenothiazinyl)propanamide IUPAC Name: N-[6-(difluoromethylsulfanyl)-1,3-benzothiazol-2-yl]-3-phenothiazin-10-ylpropanamide Traditional Name: N-[6-(difluoromethylthio)-1,3-benzothiazol-2-yl]-3-phenothiazin-10-yl-propionamide Formula: C23H17F2N3OS3 MolecularWeight: 485.592386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCC(=O)NC4=NC5=C(S4)C=C(C=C5)SC(F)F

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCC(=O)NC4=NC5=C(S4)C=C(C=C5)SC(F)F

InChI

InChI=1S/C23H17F2N3OS3/c24-22(25)30-14-9-10-15-20(13-14)32-23(26-15)27-21(29)11-12-28-16-5-1-3-7-18(16)31-19-8-4-2-6-17(19)28/h1-10,13,22H,11-12H2,(H,26,27,29)