N-[(4-acetamidophenyl)methyl]-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(4-acetamidophenyl)methyl]-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(4-acetamidophenyl)methyl]-2-chloro-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[(4-acetamidophenyl)methyl]-2-chloro-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[(4-acetamidophenyl)methyl]-2-chloro-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(4-acetamidobenzyl)-2-chloro-5-pyrrolidinosulfonyl-benzamide Formula: C20H22ClN3O4S MolecularWeight: 435.92438

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

InChI

InChI=1S/C20H22ClN3O4S/c1-14(25)23-16-6-4-15(5-7-16)13-22-20(26)18-12-17(8-9-19(18)21)29(27,28)24-10-2-3-11-24/h4-9,12H,2-3,10-11,13H2,1H3,(H,22,26)(H,23,25)