(E)-1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-3-pyridin-4-yl-prop-2-en-1-one

Systemtic Name: (E)-1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-3-pyridin-4-yl-prop-2-en-1-one Openeye Name: (E)-1-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]-3-(4-pyridyl)prop-2-en-1-one CAS Name: (E)-1-[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]-3-pyridin-4-yl-2-propen-1-one IUPAC Name: (E)-1-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]-3-pyridin-4-ylprop-2-en-1-one Traditional Name: (E)-1-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]-3-(4-pyridyl)prop-2-en-1-one Formula: C18H17ClFN3O3S MolecularWeight: 409.862283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C=CC2=CC=NC=C2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CCN1C(=O)/C=C/C2=CC=NC=C2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C18H17ClFN3O3S/c19-16-13-15(2-3-17(16)20)27(25,26)23-11-9-22(10-12-23)18(24)4-1-14-5-7-21-8-6-14/h1-8,13H,9-12H2/b4-1+