3-ethenyl-7-azabicyclo[2.2.1]hepta-1,3,5-triene; 2-methylpropane-1-thiol

Systemtic Name: 3-ethenyl-7-azabicyclo[2.2.1]hepta-1,3,5-triene; 2-methylpropane-1-thiol Openeye Name: 2-methylpropane-1-thiol; 3-vinyl-7-azabicyclo[2.2.1]hepta-1,3,5-triene CAS Name: 3-ethenyl-7-azabicyclo[2.2.1]hepta-1,3,5-triene; 2-methyl-1-propanethiol IUPAC Name: 3-ethenyl-7-azabicyclo[2.2.1]hepta-1,3,5-triene; 2-methylpropane-1-thiol Traditional Name: 2-methylpropane-1-thiol; 3-vinyl-7-azabicyclo[2.2.1]hepta-1,3,5-triene Formula: C12H17NS MolecularWeight: 207.33508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CS.C=CC1=C2C=CC(=C1)N2

Isomeric SMILES

CC(C)CS.C=CC1=C2C=CC(=C1)N2

InChI

InChI=1S/C8H7N.C4H10S/c1-2-6-5-7-3-4-8(6)9-7;1-4(2)3-5/h2-5,9H,1H2;4-5H,3H2,1-2H3