N-[3-cyano-4,5-dimethyl-1-(oxolan-2-ylmethyl)pyrrol-2-yl]-2-[4-(3-methylbutanoyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[3-cyano-4,5-dimethyl-1-(oxolan-2-ylmethyl)pyrrol-2-yl]-2-[4-(3-methylbutanoyl)piperazin-1-yl]ethanamide Openeye Name: N-[3-cyano-4,5-dimethyl-1-(tetrahydrofuran-2-ylmethyl)pyrrol-2-yl]-2-[4-(3-methylbutanoyl)piperazin-1-yl]acetamide CAS Name: N-[3-cyano-4,5-dimethyl-1-(2-oxolanylmethyl)-2-pyrrolyl]-2-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]acetamide IUPAC Name: N-[3-cyano-4,5-dimethyl-1-(oxolan-2-ylmethyl)pyrrol-2-yl]-2-[4-(3-methylbutanoyl)piperazin-1-yl]acetamide Traditional Name: N-[3-cyano-4,5-dimethyl-1-(tetrahydrofurfuryl)pyrrol-2-yl]-2-(4-isovalerylpiperazino)acetamide Formula: C23H35N5O3 MolecularWeight: 429.5557

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CN2CCN(CC2)C(=O)CC(C)C)CC3CCCO3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CN2CCN(CC2)C(=O)CC(C)C)CC3CCCO3)C

InChI

InChI=1S/C23H35N5O3/c1-16(2)12-22(30)27-9-7-26(8-10-27)15-21(29)25-23-20(13-24)17(3)18(4)28(23)14-19-6-5-11-31-19/h16,19H,5-12,14-15H2,1-4H3,(H,25,29)