N-methyl-N-(phenylmethyl)-4-(4-pyridin-3-ylcarbonylpiperazin-1-yl)sulfonyl-benzenesulfonamide

Systemtic Name: N-methyl-N-(phenylmethyl)-4-(4-pyridin-3-ylcarbonylpiperazin-1-yl)sulfonyl-benzenesulfonamide Openeye Name: N-benzyl-N-methyl-4-[4-(pyridine-3-carbonyl)piperazin-1-yl]sulfonyl-benzenesulfonamide CAS Name: N-methyl-4-[[4-[oxo(3-pyridinyl)methyl]-1-piperazinyl]sulfonyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-N-methyl-4-[4-(pyridine-3-carbonyl)piperazin-1-yl]sulfonylbenzenesulfonamide Traditional Name: N-benzyl-N-methyl-4-(4-nicotinoylpiperazino)sulfonyl-benzenesulfonamide Formula: C24H26N4O5S2 MolecularWeight: 514.61704

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=CN=CC=C4

Isomeric SMILES

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C24H26N4O5S2/c1-26(19-20-6-3-2-4-7-20)34(30,31)22-9-11-23(12-10-22)35(32,33)28-16-14-27(15-17-28)24(29)21-8-5-13-25-18-21/h2-13,18H,14-17,19H2,1H3