2-chloranyl-5-methylsulfonyl-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]benzamide

Systemtic Name: 2-chloranyl-5-methylsulfonyl-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]benzamide Openeye Name: 2-chloro-5-methylsulfonyl-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]benzamide CAS Name: 2-chloro-5-methylsulfonyl-N-[[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]benzamide IUPAC Name: 2-chloro-5-methylsulfonyl-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]benzamide Traditional Name: 2-chloro-5-mesyl-N-(4-pyrrolidinosulfonylbenzyl)benzamide Formula: C19H21ClN2O5S2 MolecularWeight: 456.96344

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H21ClN2O5S2/c1-28(24,25)16-8-9-18(20)17(12-16)19(23)21-13-14-4-6-15(7-5-14)29(26,27)22-10-2-3-11-22/h4-9,12H,2-3,10-11,13H2,1H3,(H,21,23)