N-[3-cyano-1-[(4-fluorophenyl)methyl]-4,5-dimethyl-pyrrol-2-yl]-2-(4-phenylpiperazin-1-yl)ethanamide

Systemtic Name: N-[3-cyano-1-[(4-fluorophenyl)methyl]-4,5-dimethyl-pyrrol-2-yl]-2-(4-phenylpiperazin-1-yl)ethanamide Openeye Name: N-[3-cyano-1-[(4-fluorophenyl)methyl]-4,5-dimethyl-pyrrol-2-yl]-2-(4-phenylpiperazin-1-yl)acetamide CAS Name: N-[3-cyano-1-[(4-fluorophenyl)methyl]-4,5-dimethyl-2-pyrrolyl]-2-(4-phenyl-1-piperazinyl)acetamide IUPAC Name: N-[3-cyano-1-[(4-fluorophenyl)methyl]-4,5-dimethylpyrrol-2-yl]-2-(4-phenylpiperazin-1-yl)acetamide Traditional Name: N-[3-cyano-1-(4-fluorobenzyl)-4,5-dimethyl-pyrrol-2-yl]-2-(4-phenylpiperazino)acetamide Formula: C26H28FN5O MolecularWeight: 445.531823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CN2CCN(CC2)C3=CC=CC=C3)CC4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CN2CCN(CC2)C3=CC=CC=C3)CC4=CC=C(C=C4)F)C

InChI

InChI=1S/C26H28FN5O/c1-19-20(2)32(17-21-8-10-22(27)11-9-21)26(24(19)16-28)29-25(33)18-30-12-14-31(15-13-30)23-6-4-3-5-7-23/h3-11H,12-15,17-18H2,1-2H3,(H,29,33)