N-[1-[2-[(2-cyanophenyl)carbamoylamino]-2-oxidanylidene-ethyl]piperidin-4-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[1-[2-[(2-cyanophenyl)carbamoylamino]-2-oxidanylidene-ethyl]piperidin-4-yl]-4-fluoranyl-benzamide Openeye Name: N-[1-[2-[(2-cyanophenyl)carbamoylamino]-2-oxo-ethyl]-4-piperidyl]-4-fluoro-benzamide CAS Name: N-[1-[2-[[(2-cyanoanilino)-oxomethyl]amino]-2-oxoethyl]-4-piperidinyl]-4-fluorobenzamide IUPAC Name: N-[1-[2-[(2-cyanophenyl)carbamoylamino]-2-oxoethyl]piperidin-4-yl]-4-fluorobenzamide Traditional Name: N-[1-[2-[(2-cyanophenyl)carbamoylamino]-2-keto-ethyl]-4-piperidyl]-4-fluoro-benzamide Formula: C22H22FN5O3 MolecularWeight: 423.440183

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC=C(C=C2)F)CC(=O)NC(=O)NC3=CC=CC=C3C#N

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC=C(C=C2)F)CC(=O)NC(=O)NC3=CC=CC=C3C#N

InChI

InChI=1S/C22H22FN5O3/c23-17-7-5-15(6-8-17)21(30)25-18-9-11-28(12-10-18)14-20(29)27-22(31)26-19-4-2-1-3-16(19)13-24/h1-8,18H,9-12,14H2,(H,25,30)(H2,26,27,29,31)