N-[2,5-dimethyl-3-[2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanoyl]pyrrol-1-yl]benzamide

Systemtic Name: N-[2,5-dimethyl-3-[2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanoyl]pyrrol-1-yl]benzamide Openeye Name: N-[2,5-dimethyl-3-[2-[4-(2-thienylmethyl)piperazin-1-yl]acetyl]pyrrol-1-yl]benzamide CAS Name: N-[2,5-dimethyl-3-[1-oxo-2-[4-(thiophen-2-ylmethyl)-1-piperazinyl]ethyl]-1-pyrrolyl]benzamide IUPAC Name: N-[2,5-dimethyl-3-[2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetyl]pyrrol-1-yl]benzamide Traditional Name: N-[2,5-dimethyl-3-[2-[4-(2-thenyl)piperazino]acetyl]pyrrol-1-yl]benzamide Formula: C24H28N4O2S MolecularWeight: 436.56972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1NC(=O)C2=CC=CC=C2)C)C(=O)CN3CCN(CC3)CC4=CC=CS4

Isomeric SMILES

CC1=CC(=C(N1NC(=O)C2=CC=CC=C2)C)C(=O)CN3CCN(CC3)CC4=CC=CS4

InChI

InChI=1S/C24H28N4O2S/c1-18-15-22(19(2)28(18)25-24(30)20-7-4-3-5-8-20)23(29)17-27-12-10-26(11-13-27)16-21-9-6-14-31-21/h3-9,14-15H,10-13,16-17H2,1-2H3,(H,25,30)