cyclopropyl-(pyridin-4-ylmethyl)-[(3-sulfanylidene-1H-imidazo[1,5-a]pyridin-4-ium-2-yl)methyl]azanium

Systemtic Name: cyclopropyl-(pyridin-4-ylmethyl)-[(3-sulfanylidene-1H-imidazo[1,5-a]pyridin-4-ium-2-yl)methyl]azanium Openeye Name: cyclopropyl-(4-pyridylmethyl)-[(3-thioxo-1H-imidazo[1,5-a]pyridin-4-ium-2-yl)methyl]ammonium CAS Name: cyclopropyl-(pyridin-4-ylmethyl)-[(3-sulfanylidene-1H-imidazo[1,5-a]pyridin-4-ium-2-yl)methyl]ammonium IUPAC Name: cyclopropyl-(pyridin-4-ylmethyl)-[(3-sulfanylidene-1H-imidazo[1,5-a]pyridin-4-ium-2-yl)methyl]azanium Traditional Name: cyclopropyl-(4-pyridylmethyl)-[(3-thioxo-1H-imidazo[1,5-a]pyridin-4-ium-2-yl)methyl]ammonium Formula: C17H20N4S+2 MolecularWeight: 312.4325

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1[NH+](CC2=CC=NC=C2)CN3CC4=CC=CC=[N+]4C3=S

Isomeric SMILES

C1CC1[NH+](CC2=CC=NC=C2)CN3CC4=CC=CC=[N+]4C3=S

InChI

InChI=1S/C17H19N4S/c22-17-20(12-16-3-1-2-10-21(16)17)13-19(15-4-5-15)11-14-6-8-18-9-7-14/h1-3,6-10,15H,4-5,11-13H2/q+1/p+1