1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-(4-pyrazin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-(4-pyrazin-2-ylpiperazin-1-yl)ethanone Openeye Name: 1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-(4-pyrazin-2-ylpiperazin-1-yl)ethanone CAS Name: 1-(2,5-dimethyl-1-phenethyl-3-pyrrolyl)-2-[4-(2-pyrazinyl)-1-piperazinyl]ethanone IUPAC Name: 1-(2,5-dimethyl-1-phenethylpyrrol-3-yl)-2-(4-pyrazin-2-ylpiperazin-1-yl)ethanone Traditional Name: 1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-(4-pyrazin-2-ylpiperazino)ethanone Formula: C24H29N5O MolecularWeight: 403.51996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)CN3CCN(CC3)C4=NC=CN=C4

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)CN3CCN(CC3)C4=NC=CN=C4

InChI

InChI=1S/C24H29N5O/c1-19-16-22(20(2)29(19)11-8-21-6-4-3-5-7-21)23(30)18-27-12-14-28(15-13-27)24-17-25-9-10-26-24/h3-7,9-10,16-17H,8,11-15,18H2,1-2H3