N-[6-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridin-3-yl]butane-1-sulfonamide

Systemtic Name: N-[6-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridin-3-yl]butane-1-sulfonamide Openeye Name: N-[6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]-3-pyridyl]butane-1-sulfonamide CAS Name: N-[6-[4-[oxo-[2-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-3-pyridinyl]-1-butanesulfonamide IUPAC Name: N-[6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridin-3-yl]butane-1-sulfonamide Traditional Name: N-[6-[4-[2-(trifluoromethyl)benzoyl]piperazino]-3-pyridyl]butane-1-sulfonamide Formula: C21H25F3N4O3S MolecularWeight: 470.50841

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC1=CN=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CCCCS(=O)(=O)NC1=CN=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C21H25F3N4O3S/c1-2-3-14-32(30,31)26-16-8-9-19(25-15-16)27-10-12-28(13-11-27)20(29)17-6-4-5-7-18(17)21(22,23)24/h4-9,15,26H,2-3,10-14H2,1H3