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

Systemtic Name: 3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxidanylidene-ethyl]amino]-N-(3,4-dimethoxyphenyl)-3-methyl-butanamide Openeye Name: 3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxo-ethyl]amino]-N-(3,4-dimethoxyphenyl)-3-methyl-butanamide CAS Name: 3-[[2-[(2S)-2-cyano-1-pyrrolidinyl]-2-oxoethyl]amino]-N-(3,4-dimethoxyphenyl)-3-methylbutanamide IUPAC Name: 3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amino]-N-(3,4-dimethoxyphenyl)-3-methylbutanamide Traditional Name: 3-[[2-[(2S)-2-cyanopyrrolidino]-2-keto-ethyl]amino]-N-(3,4-dimethoxyphenyl)-3-methyl-butyramide Formula: C20H28N4O4 MolecularWeight: 388.46072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N4O4/c1-20(2,22-13-19(26)24-9-5-6-15(24)12-21)11-18(25)23-14-7-8-16(27-3)17(10-14)28-4/h7-8,10,15,22H,5-6,9,11,13H2,1-4H3,(H,23,25)/t15-/m0/s1