2-[4-(1,5-dimethylpyrazol-4-yl)sulfonylpiperazin-1-ium-1-yl]-N-(4-methyl-2-oxidanylidene-chromen-7-yl)ethanamide

Systemtic Name: 2-[4-(1,5-dimethylpyrazol-4-yl)sulfonylpiperazin-1-ium-1-yl]-N-(4-methyl-2-oxidanylidene-chromen-7-yl)ethanamide Openeye Name: 2-[4-(1,5-dimethylpyrazol-4-yl)sulfonylpiperazin-1-ium-1-yl]-N-(4-methyl-2-oxo-chromen-7-yl)acetamide CAS Name: 2-[4-[(1,5-dimethyl-4-pyrazolyl)sulfonyl]-1-piperazin-1-iumyl]-N-(4-methyl-2-oxo-1-benzopyran-7-yl)acetamide IUPAC Name: 2-[4-(1,5-dimethylpyrazol-4-yl)sulfonylpiperazin-1-ium-1-yl]-N-(4-methyl-2-oxochromen-7-yl)acetamide Traditional Name: 2-[4-(1,5-dimethylpyrazol-4-yl)sulfonylpiperazin-1-ium-1-yl]-N-(2-keto-4-methyl-chromen-7-yl)acetamide Formula: C21H26N5O5S+ MolecularWeight: 460.52664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=C(N(N=C4)C)C

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=C(N(N=C4)C)C

InChI

InChI=1S/C21H25N5O5S/c1-14-10-21(28)31-18-11-16(4-5-17(14)18)23-20(27)13-25-6-8-26(9-7-25)32(29,30)19-12-22-24(3)15(19)2/h4-5,10-12H,6-9,13H2,1-3H3,(H,23,27)/p+1