8-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]sulfonyl-3-methyl-quinoline

Systemtic Name: 8-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]sulfonyl-3-methyl-quinoline Openeye Name: 8-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]sulfonyl-3-methyl-quinoline CAS Name: 8-[[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]sulfonyl]-3-methylquinoline IUPAC Name: 8-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]sulfonyl-3-methylquinoline Traditional Name: 8-[4-(3-fluoro-4-methoxy-benzyl)piperazino]sulfonyl-3-methyl-quinoline Formula: C22H24FN3O3S MolecularWeight: 429.507663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CC4=CC(=C(C=C4)OC)F

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CC4=CC(=C(C=C4)OC)F

InChI

InChI=1S/C22H24FN3O3S/c1-16-12-18-4-3-5-21(22(18)24-14-16)30(27,28)26-10-8-25(9-11-26)15-17-6-7-20(29-2)19(23)13-17/h3-7,12-14H,8-11,15H2,1-2H3