N-[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonylpyridin-3-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonylpyridin-3-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-3-pyridyl]-4-methyl-benzenesulfonamide CAS Name: N-[5-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-3-pyridinyl]-4-methylbenzenesulfonamide IUPAC Name: N-[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]pyridin-3-yl]-4-methylbenzenesulfonamide Traditional Name: 4-methyl-N-[5-(4-piperonylpiperazine-1-carbonyl)-3-pyridyl]benzenesulfonamide Formula: C25H26N4O5S MolecularWeight: 494.56274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CN=CC(=C2)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CN=CC(=C2)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H26N4O5S/c1-18-2-5-22(6-3-18)35(31,32)27-21-13-20(14-26-15-21)25(30)29-10-8-28(9-11-29)16-19-4-7-23-24(12-19)34-17-33-23/h2-7,12-15,27H,8-11,16-17H2,1H3