[2-(4-bromanylnaphthalen-2-yl)sulfonyl-6-(trifluoromethyl)phenyl]-(4-pyridin-4-ylpiperazin-1-yl)methanone

Systemtic Name: [2-(4-bromanylnaphthalen-2-yl)sulfonyl-6-(trifluoromethyl)phenyl]-(4-pyridin-4-ylpiperazin-1-yl)methanone Openeye Name: [2-[(4-bromo-2-naphthyl)sulfonyl]-6-(trifluoromethyl)phenyl]-[4-(4-pyridyl)piperazin-1-yl]methanone CAS Name: [2-[(4-bromo-2-naphthalenyl)sulfonyl]-6-(trifluoromethyl)phenyl]-(4-pyridin-4-yl-1-piperazinyl)methanone IUPAC Name: [2-(4-bromonaphthalen-2-yl)sulfonyl-6-(trifluoromethyl)phenyl]-(4-pyridin-4-ylpiperazin-1-yl)methanone Traditional Name: [2-[(4-bromo-2-naphthyl)sulfonyl]-6-(trifluoromethyl)phenyl]-[4-(4-pyridyl)piperazino]methanone Formula: C27H21BrF3N3O3S MolecularWeight: 604.43815

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=NC=C2)C(=O)C3=C(C=CC=C3S(=O)(=O)C4=CC5=CC=CC=C5C(=C4)Br)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=NC=C2)C(=O)C3=C(C=CC=C3S(=O)(=O)C4=CC5=CC=CC=C5C(=C4)Br)C(F)(F)F

InChI

InChI=1S/C27H21BrF3N3O3S/c28-23-17-20(16-18-4-1-2-5-21(18)23)38(36,37)24-7-3-6-22(27(29,30)31)25(24)26(35)34-14-12-33(13-15-34)19-8-10-32-11-9-19/h1-11,16-17H,12-15H2