N-[2-[[[(2S)-1-cyclopentylpropan-2-yl]amino]methyl]phenyl]-4-pyrrol-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[2-[[[(2S)-1-cyclopentylpropan-2-yl]amino]methyl]phenyl]-4-pyrrol-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-[2-[[[(1S)-2-cyclopentyl-1-methyl-ethyl]amino]methyl]phenyl]-4-pyrrol-1-ylsulfonyl-benzenesulfonamide CAS Name: N-[2-[[[(2S)-1-cyclopentylpropan-2-yl]amino]methyl]phenyl]-4-(1-pyrrolylsulfonyl)benzenesulfonamide IUPAC Name: N-[2-[[[(2S)-1-cyclopentylpropan-2-yl]amino]methyl]phenyl]-4-pyrrol-1-ylsulfonylbenzenesulfonamide Traditional Name: N-[2-[[[(1S)-2-cyclopentyl-1-methyl-ethyl]amino]methyl]phenyl]-4-pyrrol-1-ylsulfonyl-benzenesulfonamide Formula: C25H31N3O4S2 MolecularWeight: 501.66134

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1CCCC1)NCC2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4C=CC=C4

Isomeric SMILES

C[C@@H](CC1CCCC1)NCC2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4C=CC=C4

InChI

InChI=1S/C25H31N3O4S2/c1-20(18-21-8-2-3-9-21)26-19-22-10-4-5-11-25(22)27-33(29,30)23-12-14-24(15-13-23)34(31,32)28-16-6-7-17-28/h4-7,10-17,20-21,26-27H,2-3,8-9,18-19H2,1H3/t20-/m0/s1