2-chloranyl-N-[3-[methyl-(phenylmethyl)amino]propyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[3-[methyl-(phenylmethyl)amino]propyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[3-[benzyl(methyl)amino]propyl]-2-chloro-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[3-[methyl-(phenylmethyl)amino]propyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[3-[benzyl(methyl)amino]propyl]-2-chloro-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[3-[benzyl(methyl)amino]propyl]-2-chloro-5-pyrrolidinosulfonyl-benzamide Formula: C22H28ClN3O3S MolecularWeight: 449.99402

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Cl)CC3=CC=CC=C3

Isomeric SMILES

CN(CCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C22H28ClN3O3S/c1-25(17-18-8-3-2-4-9-18)13-7-12-24-22(27)20-16-19(10-11-21(20)23)30(28,29)26-14-5-6-15-26/h2-4,8-11,16H,5-7,12-15,17H2,1H3,(H,24,27)