4-azanyl-5-bromanyl-2-methoxy-N-[8-(thiophen-2-ylmethyl)-8-azabicyclo[3.2.1]octan-3-yl]benzamide

Systemtic Name: 4-azanyl-5-bromanyl-2-methoxy-N-[8-(thiophen-2-ylmethyl)-8-azabicyclo[3.2.1]octan-3-yl]benzamide Openeye Name: 4-amino-5-bromo-2-methoxy-N-[8-(2-thienylmethyl)-8-azabicyclo[3.2.1]octan-3-yl]benzamide CAS Name: 4-amino-5-bromo-2-methoxy-N-[8-(thiophen-2-ylmethyl)-8-azabicyclo[3.2.1]octan-3-yl]benzamide IUPAC Name: 4-amino-5-bromo-2-methoxy-N-[8-(thiophen-2-ylmethyl)-8-azabicyclo[3.2.1]octan-3-yl]benzamide Traditional Name: 4-amino-5-bromo-2-methoxy-N-[8-(2-thenyl)-8-azabicyclo[3.2.1]octan-3-yl]benzamide Formula: C20H24BrN3O2S MolecularWeight: 450.39246

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NC2CC3CCC(C2)N3CC4=CC=CS4)Br)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NC2CC3CCC(C2)N3CC4=CC=CS4)Br)N

InChI

InChI=1S/C20H24BrN3O2S/c1-26-19-10-18(22)17(21)9-16(19)20(25)23-12-7-13-4-5-14(8-12)24(13)11-15-3-2-6-27-15/h2-3,6,9-10,12-14H,4-5,7-8,11,22H2,1H3,(H,23,25)