5-methoxy-6-[(8-phenyl-1,6-diazabicyclo[3.2.1]octan-6-yl)methyl]-1,3-benzothiazole

Systemtic Name: 5-methoxy-6-[(8-phenyl-1,6-diazabicyclo[3.2.1]octan-6-yl)methyl]-1,3-benzothiazole Openeye Name: 5-methoxy-6-[(8-phenyl-1,6-diazabicyclo[3.2.1]octan-6-yl)methyl]-1,3-benzothiazole CAS Name: 5-methoxy-6-[(8-phenyl-1,6-diazabicyclo[3.2.1]octan-6-yl)methyl]-1,3-benzothiazole IUPAC Name: 5-methoxy-6-[(8-phenyl-1,6-diazabicyclo[3.2.1]octan-6-yl)methyl]-1,3-benzothiazole Traditional Name: 5-methoxy-6-[(8-phenyl-1,6-diazabicyclo[3.2.1]octan-6-yl)methyl]-1,3-benzothiazole Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1CN3CN4CCCC3C4C5=CC=CC=C5)SC=N2

Isomeric SMILES

COC1=CC2=C(C=C1CN3CN4CCCC3C4C5=CC=CC=C5)SC=N2

InChI

InChI=1S/C21H23N3OS/c1-25-19-11-17-20(26-13-22-17)10-16(19)12-24-14-23-9-5-8-18(24)21(23)15-6-3-2-4-7-15/h2-4,6-7,10-11,13,18,21H,5,8-9,12,14H2,1H3