4-fluoranyl-N-[1-(2-methylpropanoyl)piperidin-4-yl]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-fluoranyl-N-[1-(2-methylpropanoyl)piperidin-4-yl]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-fluoro-N-[1-(2-methylpropanoyl)-4-piperidyl]-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-fluoro-N-[1-(2-methyl-1-oxopropyl)-4-piperidinyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-fluoro-N-[1-(2-methylpropanoyl)piperidin-4-yl]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-fluoro-N-(1-isobutyryl-4-piperidyl)-3-piperidinosulfonyl-benzamide Formula: C21H30FN3O4S MolecularWeight: 439.544003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC(CC1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)C(=O)N1CCC(CC1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H30FN3O4S/c1-15(2)21(27)24-12-8-17(9-13-24)23-20(26)16-6-7-18(22)19(14-16)30(28,29)25-10-4-3-5-11-25/h6-7,14-15,17H,3-5,8-13H2,1-2H3,(H,23,26)