N-(3-methylphenyl)-2-[2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanoylamino]benzamide

Systemtic Name: N-(3-methylphenyl)-2-[2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanoylamino]benzamide Openeye Name: N-(m-tolyl)-2-[[2-[4-(2-thienylmethyl)piperazin-1-yl]acetyl]amino]benzamide CAS Name: N-(3-methylphenyl)-2-[[1-oxo-2-[4-(thiophen-2-ylmethyl)-1-piperazinyl]ethyl]amino]benzamide IUPAC Name: N-(3-methylphenyl)-2-[[2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetyl]amino]benzamide Traditional Name: N-(m-tolyl)-2-[[2-[4-(2-thenyl)piperazino]acetyl]amino]benzamide Formula: C25H28N4O2S MolecularWeight: 448.58042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CN3CCN(CC3)CC4=CC=CS4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CN3CCN(CC3)CC4=CC=CS4

InChI

InChI=1S/C25H28N4O2S/c1-19-6-4-7-20(16-19)26-25(31)22-9-2-3-10-23(22)27-24(30)18-29-13-11-28(12-14-29)17-21-8-5-15-32-21/h2-10,15-16H,11-14,17-18H2,1H3,(H,26,31)(H,27,30)