N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-methyl-5-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2-methyl-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-methyl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-methyl-5-piperidinosulfonyl-benzamide Formula: C25H35N4O3S+ MolecularWeight: 471.6354

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)C

InChI

InChI=1S/C25H34N4O3S/c1-3-27-15-17-28(18-16-27)24-10-6-5-9-23(24)26-25(30)22-19-21(12-11-20(22)2)33(31,32)29-13-7-4-8-14-29/h5-6,9-12,19H,3-4,7-8,13-18H2,1-2H3,(H,26,30)/p+1