N-[(3R,5R)-1-azabicyclo[3.2.1]octan-3-yl]-4-methylsulfanyl-pyrazole-1-carboxamide

Systemtic Name: N-[(3R,5R)-1-azabicyclo[3.2.1]octan-3-yl]-4-methylsulfanyl-pyrazole-1-carboxamide Openeye Name: N-[(3R,5R)-1-azabicyclo[3.2.1]octan-3-yl]-4-methylsulfanyl-pyrazole-1-carboxamide CAS Name: N-[(3R,5R)-1-azabicyclo[3.2.1]octan-3-yl]-4-(methylthio)-1-pyrazolecarboxamide IUPAC Name: N-[(3R,5R)-1-azabicyclo[3.2.1]octan-3-yl]-4-methylsulfanylpyrazole-1-carboxamide Traditional Name: N-[(3R,5R)-1-azabicyclo[3.2.1]octan-3-yl]-4-(methylthio)pyrazole-1-carboxamide Formula: C12H18N4OS MolecularWeight: 266.36252

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CN(N=C1)C(=O)NC2CC3CCN(C3)C2

Isomeric SMILES

CSC1=CN(N=C1)C(=O)N[C@@H]2C[C@H]3CCN(C3)C2

InChI

InChI=1S/C12H18N4OS/c1-18-11-5-13-16(8-11)12(17)14-10-4-9-2-3-15(6-9)7-10/h5,8-10H,2-4,6-7H2,1H3,(H,14,17)/t9-,10-/m1/s1