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

Systemtic Name: N-(4-methoxyphenyl)-2-[2-[4-(thiophen-3-ylmethyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: N-(4-methoxyphenyl)-2-[[2-[4-(3-thienylmethyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N-(4-methoxyphenyl)-2-[[1-oxo-2-[4-(3-thiophenylmethyl)-1-piperazin-1-iumyl]ethyl]amino]benzamide IUPAC Name: N-(4-methoxyphenyl)-2-[[2-[4-(thiophen-3-ylmethyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: N-(4-methoxyphenyl)-2-[[2-[4-(3-thenyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Formula: C25H29N4O3S+ MolecularWeight: 465.58776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)CC4=CSC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)CC4=CSC=C4

InChI

InChI=1S/C25H28N4O3S/c1-32-21-8-6-20(7-9-21)26-25(31)22-4-2-3-5-23(22)27-24(30)17-29-13-11-28(12-14-29)16-19-10-15-33-18-19/h2-10,15,18H,11-14,16-17H2,1H3,(H,26,31)(H,27,30)/p+1