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

Systemtic Name: 2-chloranyl-N-[2-[methyl-(phenylmethyl)amino]ethyl]-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-[benzyl(methyl)amino]ethyl]-2-chloro-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-[2-[methyl-(phenylmethyl)amino]ethyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-[benzyl(methyl)amino]ethyl]-2-chloro-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-[benzyl(methyl)amino]ethyl]-2-chloro-5-piperidinosulfonyl-benzamide Formula: C22H28ClN3O3S MolecularWeight: 449.99402

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)Cl)CC3=CC=CC=C3

Isomeric SMILES

CN(CCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)Cl)CC3=CC=CC=C3

InChI

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