N-(3-aminocarbonyl-5-ethyl-2-methyl-1H-pyrazol-2-ium-4-yl)-2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-pyridine-3-carboxamide

Systemtic Name: N-(3-aminocarbonyl-5-ethyl-2-methyl-1H-pyrazol-2-ium-4-yl)-2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-pyridine-3-carboxamide Openeye Name: N-(3-carbamoyl-5-ethyl-2-methyl-1H-pyrazol-2-ium-4-yl)-2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-pyridine-3-carboxamide CAS Name: N-(3-carbamoyl-5-ethyl-2-methyl-1H-pyrazol-2-ium-4-yl)-2-ethoxy-5-[(4-ethyl-1-piperazinyl)sulfonyl]-3-pyridinecarboxamide IUPAC Name: N-(3-carbamoyl-5-ethyl-2-methyl-1H-pyrazol-2-ium-4-yl)-2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonylpyridine-3-carboxamide Traditional Name: N-(3-carbamoyl-5-ethyl-2-methyl-1H-pyrazol-2-ium-4-yl)-2-ethoxy-5-(4-ethylpiperazino)sulfonyl-nicotinamide Formula: C21H32N7O5S+ MolecularWeight: 494.58768

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=[N+](N1)C)C(=O)N)NC(=O)C2=CC(=CN=C2OCC)S(=O)(=O)N3CCN(CC3)CC

Isomeric SMILES

CCC1=C(C(=[N+](N1)C)C(=O)N)NC(=O)C2=CC(=CN=C2OCC)S(=O)(=O)N3CCN(CC3)CC

InChI

InChI=1S/C21H31N7O5S/c1-5-16-17(18(19(22)29)26(4)25-16)24-20(30)15-12-14(13-23-21(15)33-7-3)34(31,32)28-10-8-27(6-2)9-11-28/h12-13H,5-11H2,1-4H3,(H3,22,24,29,30)/p+1