3-phenyl-5-[(3S)-thiolan-3-yl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium

Systemtic Name: 3-phenyl-5-[(3S)-thiolan-3-yl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium Openeye Name: 3-phenyl-5-[(3S)-tetrahydrothiophen-3-yl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium CAS Name: 3-phenyl-5-[(3S)-3-thiolanyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium IUPAC Name: 3-phenyl-5-[(3S)-thiolan-3-yl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium Traditional Name: 3-phenyl-5-[(3S)-tetrahydrothiophen-3-yl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium Formula: C16H20N3S+ MolecularWeight: 286.4151

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSCC1[NH+]2CCC3=C(C2)C(=NN3)C4=CC=CC=C4

Isomeric SMILES

C1CSC[C@H]1[NH+]2CCC3=C(C2)C(=NN3)C4=CC=CC=C4

InChI

InChI=1S/C16H19N3S/c1-2-4-12(5-3-1)16-14-10-19(13-7-9-20-11-13)8-6-15(14)17-18-16/h1-5,13H,6-11H2,(H,17,18)/p+1/t13-/m0/s1