N-(1H-indazol-6-yl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide

Systemtic Name: N-(1H-indazol-6-yl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide Openeye Name: N-(1H-indazol-6-yl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide CAS Name: N-(1H-indazol-6-yl)-3-(1-piperazin-4-iumylsulfonyl)propanamide IUPAC Name: N-(1H-indazol-6-yl)-3-piperazin-4-ium-1-ylsulfonylpropanamide Traditional Name: N-(1H-indazol-6-yl)-3-piperazin-4-ium-1-ylsulfonyl-propionamide Formula: C14H20N5O3S+ MolecularWeight: 338.4053

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)S(=O)(=O)CCC(=O)NC2=CC3=C(C=C2)C=NN3

Isomeric SMILES

C1CN(CC[NH2+]1)S(=O)(=O)CCC(=O)NC2=CC3=C(C=C2)C=NN3

InChI

InChI=1S/C14H19N5O3S/c20-14(3-8-23(21,22)19-6-4-15-5-7-19)17-12-2-1-11-10-16-18-13(11)9-12/h1-2,9-10,15H,3-8H2,(H,16,18)(H,17,20)/p+1