N-[2-[1-[(4,5-dimethylfuran-2-yl)methyl]piperidin-4-yl]pyrazol-3-yl]-3-fluoranyl-benzamide

Systemtic Name: N-[2-[1-[(4,5-dimethylfuran-2-yl)methyl]piperidin-4-yl]pyrazol-3-yl]-3-fluoranyl-benzamide Openeye Name: N-[2-[1-[(4,5-dimethyl-2-furyl)methyl]-4-piperidyl]pyrazol-3-yl]-3-fluoro-benzamide CAS Name: N-[2-[1-[(4,5-dimethyl-2-furanyl)methyl]-4-piperidinyl]-3-pyrazolyl]-3-fluorobenzamide IUPAC Name: N-[2-[1-[(4,5-dimethylfuran-2-yl)methyl]piperidin-4-yl]pyrazol-3-yl]-3-fluorobenzamide Traditional Name: N-[2-[1-[(4,5-dimethyl-2-furyl)methyl]-4-piperidyl]pyrazol-3-yl]-3-fluoro-benzamide Formula: C22H25FN4O2 MolecularWeight: 396.457903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)CN2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC(=CC=C4)F)C

Isomeric SMILES

CC1=C(OC(=C1)CN2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC(=CC=C4)F)C

InChI

InChI=1S/C22H25FN4O2/c1-15-12-20(29-16(15)2)14-26-10-7-19(8-11-26)27-21(6-9-24-27)25-22(28)17-4-3-5-18(23)13-17/h3-6,9,12-13,19H,7-8,10-11,14H2,1-2H3,(H,25,28)