2-[[4-(1-oxidanidylpyridin-1-ium-2-yl)piperazin-1-yl]methyl]-[1,3]thiazolo[5,4-b]pyridine

Systemtic Name: 2-[[4-(1-oxidanidylpyridin-1-ium-2-yl)piperazin-1-yl]methyl]-[1,3]thiazolo[5,4-b]pyridine Openeye Name: 2-[[4-(1-oxidopyridin-1-ium-2-yl)piperazin-1-yl]methyl]thiazolo[5,4-b]pyridine CAS Name: 2-[[4-(1-oxido-2-pyridin-1-iumyl)-1-piperazinyl]methyl]thiazolo[5,4-b]pyridine IUPAC Name: 2-[[4-(1-oxidopyridin-1-ium-2-yl)piperazin-1-yl]methyl]-[1,3]thiazolo[5,4-b]pyridine Traditional Name: 2-[[4-(1-oxidopyridin-1-ium-2-yl)piperazino]methyl]thiazolo[5,4-b]pyridine Formula: C16H17N5OS MolecularWeight: 327.40408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=C(S2)N=CC=C3)C4=CC=CC=[N+]4[O-]

Isomeric SMILES

C1CN(CCN1CC2=NC3=C(S2)N=CC=C3)C4=CC=CC=[N+]4[O-]

InChI

InChI=1S/C16H17N5OS/c22-21-7-2-1-5-15(21)20-10-8-19(9-11-20)12-14-18-13-4-3-6-17-16(13)23-14/h1-7H,8-12H2