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

Systemtic Name: N-[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]-2-[4-(3-methylbutanoyl)piperazin-1-yl]ethanamide Openeye Name: N-[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]-2-[4-(3-methylbutanoyl)piperazin-1-yl]acetamide CAS Name: N-[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-2-pyrrolyl]-2-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]acetamide IUPAC Name: N-[3-cyano-1-(3-methoxypropyl)-4,5-dimethylpyrrol-2-yl]-2-[4-(3-methylbutanoyl)piperazin-1-yl]acetamide Traditional Name: N-[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]-2-(4-isovalerylpiperazino)acetamide Formula: C22H35N5O3 MolecularWeight: 417.545

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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)CCCOC)C

Isomeric SMILES

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

InChI

InChI=1S/C22H35N5O3/c1-16(2)13-21(29)26-10-8-25(9-11-26)15-20(28)24-22-19(14-23)17(3)18(4)27(22)7-6-12-30-5/h16H,6-13,15H2,1-5H3,(H,24,28)