1-methoxy-4-methylsulfanyl-N-[8-(phenylmethyl)-8-azabicyclo[3.2.1]octan-3-yl]naphthalene-2-carboxamide

Systemtic Name: 1-methoxy-4-methylsulfanyl-N-[8-(phenylmethyl)-8-azabicyclo[3.2.1]octan-3-yl]naphthalene-2-carboxamide Openeye Name: N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-1-methoxy-4-methylsulfanyl-naphthalene-2-carboxamide CAS Name: 1-methoxy-4-(methylthio)-N-[8-(phenylmethyl)-8-azabicyclo[3.2.1]octan-3-yl]-2-naphthalenecarboxamide IUPAC Name: N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-1-methoxy-4-methylsulfanylnaphthalene-2-carboxamide Traditional Name: N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-1-methoxy-4-(methylthio)-2-naphthamide Formula: C27H30N2O2S MolecularWeight: 446.6043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C2=CC=CC=C21)SC)C(=O)NC3CC4CCC(C3)N4CC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C(C2=CC=CC=C21)SC)C(=O)NC3CC4CCC(C3)N4CC5=CC=CC=C5

InChI

InChI=1S/C27H30N2O2S/c1-31-26-23-11-7-6-10-22(23)25(32-2)16-24(26)27(30)28-19-14-20-12-13-21(15-19)29(20)17-18-8-4-3-5-9-18/h3-11,16,19-21H,12-15,17H2,1-2H3,(H,28,30)