3-cyclohexyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]propanamide

Systemtic Name: 3-cyclohexyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]propanamide Openeye Name: 3-cyclohexyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: 3-cyclohexyl-N-[2-(4-methyl-1-piperazin-4-iumyl)-5-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: 3-cyclohexyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-piperidin-1-ylsulfonylphenyl]propanamide Traditional Name: 3-cyclohexyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-piperidinosulfonyl-phenyl]propionamide Formula: C25H41N4O3S+ MolecularWeight: 477.68304

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NC(=O)CCC4CCCCC4

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NC(=O)CCC4CCCCC4

InChI

InChI=1S/C25H40N4O3S/c1-27-16-18-28(19-17-27)24-12-11-22(33(31,32)29-14-6-3-7-15-29)20-23(24)26-25(30)13-10-21-8-4-2-5-9-21/h11-12,20-21H,2-10,13-19H2,1H3,(H,26,30)/p+1