3-oxidanylidene-2-phenyl-5-(phenylmethyl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide

Systemtic Name: 3-oxidanylidene-2-phenyl-5-(phenylmethyl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Openeye Name: 5-benzyl-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide CAS Name: 3-oxo-2-phenyl-5-(phenylmethyl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide IUPAC Name: 5-benzyl-3-oxo-2-phenyl-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Traditional Name: 5-benzyl-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-keto-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Formula: C25H23N6O2S+ MolecularWeight: 471.55412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(S1)NC(=O)C2=C3C(=C[N+](=C2)CC4=CC=CC=C4)C(=O)N(N3)C5=CC=CC=C5

Isomeric SMILES

CC(C)C1=NN=C(S1)NC(=O)C2=C3C(=C[N+](=C2)CC4=CC=CC=C4)C(=O)N(N3)C5=CC=CC=C5

InChI

InChI=1S/C25H22N6O2S/c1-16(2)23-27-28-25(34-23)26-22(32)19-14-30(13-17-9-5-3-6-10-17)15-20-21(19)29-31(24(20)33)18-11-7-4-8-12-18/h3-12,14-16H,13H2,1-2H3,(H,26,28,32)/p+1