6-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]-N,N-di(propan-2-yl)pyridine-3-sulfonamide

Systemtic Name: 6-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]-N,N-di(propan-2-yl)pyridine-3-sulfonamide Openeye Name: 6-[4-(2-fluorobenzoyl)piperazin-1-yl]-N,N-diisopropyl-pyridine-3-sulfonamide CAS Name: 6-[4-[(2-fluorophenyl)-oxomethyl]-1-piperazinyl]-N,N-di(propan-2-yl)-3-pyridinesulfonamide IUPAC Name: 6-[4-(2-fluorobenzoyl)piperazin-1-yl]-N,N-di(propan-2-yl)pyridine-3-sulfonamide Traditional Name: 6-[4-(2-fluorobenzoyl)piperazino]-N,N-diisopropyl-pyridine-3-sulfonamide Formula: C22H29FN4O3S MolecularWeight: 448.554063

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)S(=O)(=O)C1=CN=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3F

Isomeric SMILES

CC(C)N(C(C)C)S(=O)(=O)C1=CN=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H29FN4O3S/c1-16(2)27(17(3)4)31(29,30)18-9-10-21(24-15-18)25-11-13-26(14-12-25)22(28)19-7-5-6-8-20(19)23/h5-10,15-17H,11-14H2,1-4H3