cyclopentyl-[(5R)-1-methyl-3-(pyridin-4-ylmethylcarbamoyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium

Systemtic Name: cyclopentyl-[(5R)-1-methyl-3-(pyridin-4-ylmethylcarbamoyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: cyclopentyl-[(5R)-1-methyl-3-(4-pyridylmethylcarbamoyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: cyclopentyl-[(5R)-1-methyl-3-[oxo-(pyridin-4-ylmethylamino)methyl]-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: cyclopentyl-[(5R)-1-methyl-3-(pyridin-4-ylmethylcarbamoyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: cyclopentyl-[(5R)-1-methyl-3-(4-pyridylmethylcarbamoyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C20H28N5O+ MolecularWeight: 354.46922

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)[NH2+]C3CCCC3)C(=N1)C(=O)NCC4=CC=NC=C4

Isomeric SMILES

CN1C2=C(C[C@@H](CC2)[NH2+]C3CCCC3)C(=N1)C(=O)NCC4=CC=NC=C4

InChI

InChI=1S/C20H27N5O/c1-25-18-7-6-16(23-15-4-2-3-5-15)12-17(18)19(24-25)20(26)22-13-14-8-10-21-11-9-14/h8-11,15-16,23H,2-7,12-13H2,1H3,(H,22,26)/p+1/t16-/m1/s1