3-[3-[3-(5-oxidanylpent-1-ynyl)-8-azabicyclo[3.2.1]oct-3-en-8-yl]propyl]-1,3-benzothiazol-2-one

Systemtic Name: 3-[3-[3-(5-oxidanylpent-1-ynyl)-8-azabicyclo[3.2.1]oct-3-en-8-yl]propyl]-1,3-benzothiazol-2-one Openeye Name: 3-[3-[3-(5-hydroxypent-1-ynyl)-8-azabicyclo[3.2.1]oct-3-en-8-yl]propyl]-1,3-benzothiazol-2-one CAS Name: 3-[3-[3-(5-hydroxypent-1-ynyl)-8-azabicyclo[3.2.1]oct-3-en-8-yl]propyl]-1,3-benzothiazol-2-one IUPAC Name: 3-[3-[3-(5-hydroxypent-1-ynyl)-8-azabicyclo[3.2.1]oct-3-en-8-yl]propyl]-1,3-benzothiazol-2-one Traditional Name: 3-[3-[3-(5-hydroxypent-1-ynyl)-8-azabicyclo[3.2.1]oct-3-en-8-yl]propyl]-1,3-benzothiazol-2-one Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C=C(CC1N2CCCN3C4=CC=CC=C4SC3=O)C#CCCCO

Isomeric SMILES

C1CC2C=C(CC1N2CCCN3C4=CC=CC=C4SC3=O)C#CCCCO

InChI

InChI=1S/C22H26N2O2S/c25-14-5-1-2-7-17-15-18-10-11-19(16-17)23(18)12-6-13-24-20-8-3-4-9-21(20)27-22(24)26/h3-4,8-9,15,18-19,25H,1,5-6,10-14,16H2