5-[4-[2,6-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]sulfonyl-2-methyl-1,3-benzothiazole

Systemtic Name: 5-[4-[2,6-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]sulfonyl-2-methyl-1,3-benzothiazole Openeye Name: 5-[4-(2,6-difluorophenyl)sulfonylpiperazin-1-yl]sulfonyl-2-methyl-1,3-benzothiazole CAS Name: 5-[[4-(2,6-difluorophenyl)sulfonyl-1-piperazinyl]sulfonyl]-2-methyl-1,3-benzothiazole IUPAC Name: 5-[4-(2,6-difluorophenyl)sulfonylpiperazin-1-yl]sulfonyl-2-methyl-1,3-benzothiazole Traditional Name: 5-[4-(2,6-difluorophenyl)sulfonylpiperazino]sulfonyl-2-methyl-1,3-benzothiazole Formula: C18H17F2N3O4S3 MolecularWeight: 473.537086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)S(=O)(=O)C4=C(C=CC=C4F)F

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)S(=O)(=O)C4=C(C=CC=C4F)F

InChI

InChI=1S/C18H17F2N3O4S3/c1-12-21-16-11-13(5-6-17(16)28-12)29(24,25)22-7-9-23(10-8-22)30(26,27)18-14(19)3-2-4-15(18)20/h2-6,11H,7-10H2,1H3