4-methyl-3-piperidin-1-ylsulfonyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 4-methyl-3-piperidin-1-ylsulfonyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 4-methyl-3-(1-piperidylsulfonyl)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 4-methyl-3-(1-piperidinylsulfonyl)-N-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]benzamide IUPAC Name: 4-methyl-3-piperidin-1-ylsulfonyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 4-methyl-3-piperidinosulfonyl-N-[2-(pyrrolidinomethyl)benzyl]benzamide Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=C2CN3CCCC3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=C2CN3CCCC3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C25H33N3O3S/c1-20-11-12-21(17-24(20)32(30,31)28-15-5-2-6-16-28)25(29)26-18-22-9-3-4-10-23(22)19-27-13-7-8-14-27/h3-4,9-12,17H,2,5-8,13-16,18-19H2,1H3,(H,26,29)