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

Systemtic Name: N-[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]-2-[4-(2-hydroxyphenyl)piperazin-1-yl]ethanamide Openeye Name: N-[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide CAS Name: N-[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-2-pyrrolyl]-2-[4-(2-hydroxyphenyl)-1-piperazinyl]acetamide IUPAC Name: N-[3-cyano-1-(3-methoxypropyl)-4,5-dimethylpyrrol-2-yl]-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide Traditional Name: N-[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]-2-[4-(2-hydroxyphenyl)piperazino]acetamide Formula: C23H31N5O3 MolecularWeight: 425.52394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CN2CCN(CC2)C3=CC=CC=C3O)CCCOC)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CN2CCN(CC2)C3=CC=CC=C3O)CCCOC)C

InChI

InChI=1S/C23H31N5O3/c1-17-18(2)28(9-6-14-31-3)23(19(17)15-24)25-22(30)16-26-10-12-27(13-11-26)20-7-4-5-8-21(20)29/h4-5,7-8,29H,6,9-14,16H2,1-3H3,(H,25,30)