1-[1-(4-chloranyl-3-fluoranyl-phenyl)sulfonylpiperidin-4-yl]-5-fluoranyl-benzotriazole

Systemtic Name: 1-[1-(4-chloranyl-3-fluoranyl-phenyl)sulfonylpiperidin-4-yl]-5-fluoranyl-benzotriazole Openeye Name: 1-[1-(4-chloro-3-fluoro-phenyl)sulfonyl-4-piperidyl]-5-fluoro-benzotriazole CAS Name: 1-[1-(4-chloro-3-fluorophenyl)sulfonyl-4-piperidinyl]-5-fluorobenzotriazole IUPAC Name: 1-[1-(4-chloro-3-fluorophenyl)sulfonylpiperidin-4-yl]-5-fluorobenzotriazole Traditional Name: 1-[1-(4-chloro-3-fluoro-phenyl)sulfonyl-4-piperidyl]-5-fluoro-benzotriazole Formula: C17H15ClF2N4O2S MolecularWeight: 412.841406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=C(C=C(C=C3)F)N=N2)S(=O)(=O)C4=CC(=C(C=C4)Cl)F

Isomeric SMILES

C1CN(CCC1N2C3=C(C=C(C=C3)F)N=N2)S(=O)(=O)C4=CC(=C(C=C4)Cl)F

InChI

InChI=1S/C17H15ClF2N4O2S/c18-14-3-2-13(10-15(14)20)27(25,26)23-7-5-12(6-8-23)24-17-4-1-11(19)9-16(17)21-22-24/h1-4,9-10,12H,5-8H2