N-cyclopropyl-4-[(2S)-4-methyl-2-phenyl-piperazin-1-yl]sulfonyl-benzenesulfonamide

Systemtic Name: N-cyclopropyl-4-[(2S)-4-methyl-2-phenyl-piperazin-1-yl]sulfonyl-benzenesulfonamide Openeye Name: N-cyclopropyl-4-[(2S)-4-methyl-2-phenyl-piperazin-1-yl]sulfonyl-benzenesulfonamide CAS Name: N-cyclopropyl-4-[[(2S)-4-methyl-2-phenyl-1-piperazinyl]sulfonyl]benzenesulfonamide IUPAC Name: N-cyclopropyl-4-[(2S)-4-methyl-2-phenylpiperazin-1-yl]sulfonylbenzenesulfonamide Traditional Name: N-cyclopropyl-4-[(2S)-4-methyl-2-phenyl-piperazino]sulfonyl-benzenesulfonamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C(C1)C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)NC4CC4

Isomeric SMILES

CN1CCN([C@H](C1)C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)NC4CC4

InChI

InChI=1S/C20H25N3O4S2/c1-22-13-14-23(20(15-22)16-5-3-2-4-6-16)29(26,27)19-11-9-18(10-12-19)28(24,25)21-17-7-8-17/h2-6,9-12,17,20-21H,7-8,13-15H2,1H3/t20-/m1/s1