N-[1-[4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-butanoyl]piperidin-4-yl]-2-fluoranyl-benzamide

Systemtic Name: N-[1-[4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-butanoyl]piperidin-4-yl]-2-fluoranyl-benzamide Openeye Name: N-[1-[4-(2,5-dimethyl-3-thienyl)-4-oxo-butanoyl]-4-piperidyl]-2-fluoro-benzamide CAS Name: N-[1-[4-(2,5-dimethyl-3-thiophenyl)-1,4-dioxobutyl]-4-piperidinyl]-2-fluorobenzamide IUPAC Name: N-[1-[4-(2,5-dimethylthiophen-3-yl)-4-oxobutanoyl]piperidin-4-yl]-2-fluorobenzamide Traditional Name: N-[1-[4-(2,5-dimethyl-3-thienyl)-4-keto-butanoyl]-4-piperidyl]-2-fluoro-benzamide Formula: C22H25FN2O3S MolecularWeight: 416.508903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CCC(=O)N2CCC(CC2)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CCC(=O)N2CCC(CC2)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H25FN2O3S/c1-14-13-18(15(2)29-14)20(26)7-8-21(27)25-11-9-16(10-12-25)24-22(28)17-5-3-4-6-19(17)23/h3-6,13,16H,7-12H2,1-2H3,(H,24,28)