2,6-dimethyl-3-methylsulfanyl-4a,5,7,8,8a,9-hexahydro-4H-pyrazolo[3,4-g]isoquinoline

Systemtic Name: 2,6-dimethyl-3-methylsulfanyl-4a,5,7,8,8a,9-hexahydro-4H-pyrazolo[3,4-g]isoquinoline Openeye Name: 2,6-dimethyl-3-methylsulfanyl-4a,5,7,8,8a,9-hexahydro-4H-pyrazolo[3,4-g]isoquinoline CAS Name: 2,6-dimethyl-3-(methylthio)-4a,5,7,8,8a,9-hexahydro-4H-pyrazolo[3,4-g]isoquinoline IUPAC Name: 2,6-dimethyl-3-methylsulfanyl-4a,5,7,8,8a,9-hexahydro-4H-pyrazolo[3,4-g]isoquinoline Traditional Name: 2,6-dimethyl-3-(methylthio)-4a,5,7,8,8a,9-hexahydro-4H-pyrazol[3,4-g]isoquinoline Formula: C13H21N3S MolecularWeight: 251.39094

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2CC3=NN(C(=C3CC2C1)SC)C

Isomeric SMILES

CN1CCC2CC3=NN(C(=C3CC2C1)SC)C

InChI

InChI=1S/C13H21N3S/c1-15-5-4-9-7-12-11(6-10(9)8-15)13(17-3)16(2)14-12/h9-10H,4-8H2,1-3H3