1-(3-fluoranyl-4-methoxy-phenyl)sulfonyl-4-(pyridin-4-ylmethyl)piperazine

Systemtic Name: 1-(3-fluoranyl-4-methoxy-phenyl)sulfonyl-4-(pyridin-4-ylmethyl)piperazine Openeye Name: 1-(3-fluoro-4-methoxy-phenyl)sulfonyl-4-(4-pyridylmethyl)piperazine CAS Name: 1-(3-fluoro-4-methoxyphenyl)sulfonyl-4-(pyridin-4-ylmethyl)piperazine IUPAC Name: 1-(3-fluoro-4-methoxyphenyl)sulfonyl-4-(pyridin-4-ylmethyl)piperazine Traditional Name: 1-(3-fluoro-4-methoxy-phenyl)sulfonyl-4-(4-pyridylmethyl)piperazine Formula: C17H20FN3O3S MolecularWeight: 365.422403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=NC=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=NC=C3)F

InChI

InChI=1S/C17H20FN3O3S/c1-24-17-3-2-15(12-16(17)18)25(22,23)21-10-8-20(9-11-21)13-14-4-6-19-7-5-14/h2-7,12H,8-11,13H2,1H3