3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxidanylidene-ethyl]amino]-N-(4-fluorophenyl)-3-methyl-butanamide

Systemtic Name: 3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxidanylidene-ethyl]amino]-N-(4-fluorophenyl)-3-methyl-butanamide Openeye Name: 3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxo-ethyl]amino]-N-(4-fluorophenyl)-3-methyl-butanamide CAS Name: 3-[[2-[(2S)-2-cyano-1-pyrrolidinyl]-2-oxoethyl]amino]-N-(4-fluorophenyl)-3-methylbutanamide IUPAC Name: 3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amino]-N-(4-fluorophenyl)-3-methylbutanamide Traditional Name: 3-[[2-[(2S)-2-cyanopyrrolidino]-2-keto-ethyl]amino]-N-(4-fluorophenyl)-3-methyl-butyramide Formula: C18H23FN4O2 MolecularWeight: 346.399223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NC1=CC=C(C=C1)F)NCC(=O)N2CCCC2C#N

Isomeric SMILES

CC(C)(CC(=O)NC1=CC=C(C=C1)F)NCC(=O)N2CCC[C@H]2C#N

InChI

InChI=1S/C18H23FN4O2/c1-18(2,10-16(24)22-14-7-5-13(19)6-8-14)21-12-17(25)23-9-3-4-15(23)11-20/h5-8,15,21H,3-4,9-10,12H2,1-2H3,(H,22,24)/t15-/m0/s1