4-methyl-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-methyl-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-methyl-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-methyl-N-[2-phenyl-2-(1-pyrrolidinyl)ethyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-methyl-N-(2-phenyl-2-pyrrolidin-1-ylethyl)-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-methyl-N-(2-phenyl-2-pyrrolidino-ethyl)-3-piperidinosulfonyl-benzamide Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(C2=CC=CC=C2)N3CCCC3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(C2=CC=CC=C2)N3CCCC3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C25H33N3O3S/c1-20-12-13-22(18-24(20)32(30,31)28-16-6-3-7-17-28)25(29)26-19-23(27-14-8-9-15-27)21-10-4-2-5-11-21/h2,4-5,10-13,18,23H,3,6-9,14-17,19H2,1H3,(H,26,29)