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

Systemtic Name: 2-chloranyl-N-[2-[methyl-(phenylmethyl)amino]ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-[benzyl(methyl)amino]ethyl]-2-chloro-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[2-[methyl-(phenylmethyl)amino]ethyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-[benzyl(methyl)amino]ethyl]-2-chloro-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-[benzyl(methyl)amino]ethyl]-2-chloro-5-pyrrolidinosulfonyl-benzamide Formula: C21H26ClN3O3S MolecularWeight: 435.96744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26ClN3O3S/c1-24(16-17-7-3-2-4-8-17)14-11-23-21(26)19-15-18(9-10-20(19)22)29(27,28)25-12-5-6-13-25/h2-4,7-10,15H,5-6,11-14,16H2,1H3,(H,23,26)