4-azanyl-5-ethylsulfonyl-2-methoxy-N-[8-(phenylmethyl)-8-azabicyclo[3.2.1]octan-5-yl]benzamide

Systemtic Name: 4-azanyl-5-ethylsulfonyl-2-methoxy-N-[8-(phenylmethyl)-8-azabicyclo[3.2.1]octan-5-yl]benzamide Openeye Name: 4-amino-N-(8-benzyl-8-azabicyclo[3.2.1]octan-5-yl)-5-ethylsulfonyl-2-methoxy-benzamide CAS Name: 4-amino-5-ethylsulfonyl-2-methoxy-N-[8-(phenylmethyl)-8-azabicyclo[3.2.1]octan-5-yl]benzamide IUPAC Name: 4-amino-N-(8-benzyl-8-azabicyclo[3.2.1]octan-5-yl)-5-ethylsulfonyl-2-methoxybenzamide Traditional Name: 4-amino-N-(8-benzyl-8-azabicyclo[3.2.1]octan-5-yl)-5-esyl-2-methoxy-benzamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C(C=C(C(=C1)C(=O)NC23CCCC(N2CC4=CC=CC=C4)CC3)OC)N

Isomeric SMILES

CCS(=O)(=O)C1=C(C=C(C(=C1)C(=O)NC23CCCC(N2CC4=CC=CC=C4)CC3)OC)N

InChI

InChI=1S/C24H31N3O4S/c1-3-32(29,30)22-14-19(21(31-2)15-20(22)25)23(28)26-24-12-7-10-18(11-13-24)27(24)16-17-8-5-4-6-9-17/h4-6,8-9,14-15,18H,3,7,10-13,16,25H2,1-2H3,(H,26,28)