N-[1-[3-[(3-cyanothiophen-2-yl)amino]-3-oxidanylidene-propyl]piperidin-4-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[1-[3-[(3-cyanothiophen-2-yl)amino]-3-oxidanylidene-propyl]piperidin-4-yl]-4-fluoranyl-benzamide Openeye Name: N-[1-[3-[(3-cyano-2-thienyl)amino]-3-oxo-propyl]-4-piperidyl]-4-fluoro-benzamide CAS Name: N-[1-[3-[(3-cyano-2-thiophenyl)amino]-3-oxopropyl]-4-piperidinyl]-4-fluorobenzamide IUPAC Name: N-[1-[3-[(3-cyanothiophen-2-yl)amino]-3-oxopropyl]piperidin-4-yl]-4-fluorobenzamide Traditional Name: N-[1-[3-[(3-cyano-2-thienyl)amino]-3-keto-propyl]-4-piperidyl]-4-fluoro-benzamide Formula: C20H21FN4O2S MolecularWeight: 400.469743

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC=C(C=C2)F)CCC(=O)NC3=C(C=CS3)C#N

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC=C(C=C2)F)CCC(=O)NC3=C(C=CS3)C#N

InChI

InChI=1S/C20H21FN4O2S/c21-16-3-1-14(2-4-16)19(27)23-17-5-9-25(10-6-17)11-7-18(26)24-20-15(13-22)8-12-28-20/h1-4,8,12,17H,5-7,9-11H2,(H,23,27)(H,24,26)