4-[[2,3-bis(chloranyl)phenyl]methyl-methylsulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)benzamide

Systemtic Name: 4-[[2,3-bis(chloranyl)phenyl]methyl-methylsulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)benzamide Openeye Name: 4-[(2,3-dichlorophenyl)methyl-methylsulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)benzamide CAS Name: 4-[(2,3-dichlorophenyl)methyl-methylsulfonylamino]-N-[3-(1-pyrrolidinyl)propyl]benzamide IUPAC Name: 4-[(2,3-dichlorophenyl)methyl-methylsulfonylamino]-N-(3-pyrrolidin-1-ylpropyl)benzamide Traditional Name: 4-[(2,3-dichlorobenzyl)-mesyl-amino]-N-(3-pyrrolidinopropyl)benzamide Formula: C22H27Cl2N3O3S MolecularWeight: 484.43908

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=C(C(=CC=C1)Cl)Cl)C2=CC=C(C=C2)C(=O)NCCCN3CCCC3

Isomeric SMILES

CS(=O)(=O)N(CC1=C(C(=CC=C1)Cl)Cl)C2=CC=C(C=C2)C(=O)NCCCN3CCCC3

InChI

InChI=1S/C22H27Cl2N3O3S/c1-31(29,30)27(16-18-6-4-7-20(23)21(18)24)19-10-8-17(9-11-19)22(28)25-12-5-15-26-13-2-3-14-26/h4,6-11H,2-3,5,12-16H2,1H3,(H,25,28)