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

Systemtic Name: 3-[3-(3-pent-1-ynyl-8-azabicyclo[3.2.1]oct-3-en-8-yl)propyl]-1,3-benzothiazol-2-one Openeye Name: 3-[3-(3-pent-1-ynyl-8-azabicyclo[3.2.1]oct-3-en-8-yl)propyl]-1,3-benzothiazol-2-one CAS Name: 3-[3-(3-pent-1-ynyl-8-azabicyclo[3.2.1]oct-3-en-8-yl)propyl]-1,3-benzothiazol-2-one IUPAC Name: 3-[3-(3-pent-1-ynyl-8-azabicyclo[3.2.1]oct-3-en-8-yl)propyl]-1,3-benzothiazol-2-one Traditional Name: 3-[3-(3-pent-1-ynyl-8-azabicyclo[3.2.1]oct-3-en-8-yl)propyl]-1,3-benzothiazol-2-one Formula: C22H26N2OS MolecularWeight: 366.51964

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC1=CC2CCC(C1)N2CCCN3C4=CC=CC=C4SC3=O

Isomeric SMILES

CCCC#CC1=CC2CCC(C1)N2CCCN3C4=CC=CC=C4SC3=O

InChI

InChI=1S/C22H26N2OS/c1-2-3-4-8-17-15-18-11-12-19(16-17)23(18)13-7-14-24-20-9-5-6-10-21(20)26-22(24)25/h5-6,9-10,15,18-19H,2-3,7,11-14,16H2,1H3