N-[2-[(2S)-butan-2-yl]phenyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[2-[(2S)-butan-2-yl]phenyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-[2-[(1S)-1-methylpropyl]phenyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-[2-[(2S)-butan-2-yl]phenyl]-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-[2-[(2S)-butan-2-yl]phenyl]-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-[2-[(1S)-1-methylpropyl]phenyl]-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C20H26N2O4S2 MolecularWeight: 422.56144

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H26N2O4S2/c1-3-16(2)19-8-4-5-9-20(19)21-27(23,24)17-10-12-18(13-11-17)28(25,26)22-14-6-7-15-22/h4-5,8-13,16,21H,3,6-7,14-15H2,1-2H3/t16-/m0/s1