1-[4-bromanyl-2,5-bis(fluoranyl)phenyl]sulfonyl-4-(2,6-dimethylphenyl)piperazine

Systemtic Name: 1-[4-bromanyl-2,5-bis(fluoranyl)phenyl]sulfonyl-4-(2,6-dimethylphenyl)piperazine Openeye Name: 1-(4-bromo-2,5-difluoro-phenyl)sulfonyl-4-(2,6-dimethylphenyl)piperazine CAS Name: 1-(4-bromo-2,5-difluorophenyl)sulfonyl-4-(2,6-dimethylphenyl)piperazine IUPAC Name: 1-(4-bromo-2,5-difluorophenyl)sulfonyl-4-(2,6-dimethylphenyl)piperazine Traditional Name: 1-(4-bromo-2,5-difluoro-phenyl)sulfonyl-4-(2,6-dimethylphenyl)piperazine Formula: C18H19BrF2N2O2S MolecularWeight: 445.321466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2CCN(CC2)S(=O)(=O)C3=C(C=C(C(=C3)F)Br)F

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2CCN(CC2)S(=O)(=O)C3=C(C=C(C(=C3)F)Br)F

InChI

InChI=1S/C18H19BrF2N2O2S/c1-12-4-3-5-13(2)18(12)22-6-8-23(9-7-22)26(24,25)17-11-15(20)14(19)10-16(17)21/h3-5,10-11H,6-9H2,1-2H3