N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-1-cyclopropyl-6-(propylcarbamoylamino)indazole-3-carboxamide

Systemtic Name: N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-1-cyclopropyl-6-(propylcarbamoylamino)indazole-3-carboxamide Openeye Name: 1-cyclopropyl-6-(propylcarbamoylamino)-N-[(3S)-quinuclidin-3-yl]indazole-3-carboxamide CAS Name: N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-1-cyclopropyl-6-[[oxo(propylamino)methyl]amino]-3-indazolecarboxamide IUPAC Name: N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-1-cyclopropyl-6-(propylcarbamoylamino)indazole-3-carboxamide Traditional Name: 1-cyclopropyl-6-(propylcarbamoylamino)-N-[(3S)-quinuclidin-3-yl]indazole-3-carboxamide Formula: C22H30N6O2 MolecularWeight: 410.5126

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC1=CC2=C(C=C1)C(=NN2C3CC3)C(=O)NC4CN5CCC4CC5

Isomeric SMILES

CCCNC(=O)NC1=CC2=C(C=C1)C(=NN2C3CC3)C(=O)N[C@@H]4CN5CCC4CC5

InChI

InChI=1S/C22H30N6O2/c1-2-9-23-22(30)24-15-3-6-17-19(12-15)28(16-4-5-16)26-20(17)21(29)25-18-13-27-10-7-14(18)8-11-27/h3,6,12,14,16,18H,2,4-5,7-11,13H2,1H3,(H,25,29)(H2,23,24,30)/t18-/m1/s1