4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-1-(1-methylimidazol-4-yl)sulfonyl-N-oxidanyl-piperidine-4-carboxamide; 1-methylimidazole-4-sulfonyl chloride

Systemtic Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-1-(1-methylimidazol-4-yl)sulfonyl-N-oxidanyl-piperidine-4-carboxamide; 1-methylimidazole-4-sulfonyl chloride Openeye Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-1-(1-methylimidazol-4-yl)sulfonyl-piperidine-4-carbohydroxamic acid; 1-methylimidazole-4-sulfonyl chloride CAS Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-N-hydroxy-1-[(1-methyl-4-imidazolyl)sulfonyl]-4-piperidinecarboxamide; 1-methyl-4-imidazolesulfonyl chloride IUPAC Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-N-hydroxy-1-(1-methylimidazol-4-yl)sulfonylpiperidine-4-carboxamide; 1-methylimidazole-4-sulfonyl chloride Traditional Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-1-(1-methylimidazol-4-yl)sulfonyl-piperidine-4-carbohydroxamic acid; 1-methylimidazole-4-sulfonyl chloride Formula: C25H31ClN6O9S3 MolecularWeight: 691.19644

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)CC2(CCN(CC2)S(=O)(=O)C3=CN(C=N3)C)C(=O)NO.CN1C=C(N=C1)S(=O)(=O)Cl

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)CC2(CCN(CC2)S(=O)(=O)C3=CN(C=N3)C)C(=O)NO.CN1C=C(N=C1)S(=O)(=O)Cl

InChI

InChI=1S/C21H26N4O7S2.C4H5ClN2O2S/c1-3-4-13-32-17-5-7-18(8-6-17)33(28,29)15-21(20(26)23-27)9-11-25(12-10-21)34(30,31)19-14-24(2)16-22-19;1-7-2-4(6-3-7)10(5,8)9/h5-8,14,16,27H,9-13,15H2,1-2H3,(H,23,26);2-3H,1H3