N-[5-[(4-but-2-ynoxyphenyl)sulfonylamino]-6-(oxidanylamino)-6-oxidanylidene-hexyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[5-[(4-but-2-ynoxyphenyl)sulfonylamino]-6-(oxidanylamino)-6-oxidanylidene-hexyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Openeye Name: N-[5-[(4-but-2-ynoxyphenyl)sulfonylamino]-6-(hydroxyamino)-6-oxo-hexyl]-3,5-dimethyl-isoxazole-4-carboxamide CAS Name: N-[5-[(4-but-2-ynoxyphenyl)sulfonylamino]-6-(hydroxyamino)-6-oxohexyl]-3,5-dimethyl-4-isoxazolecarboxamide IUPAC Name: N-[5-[(4-but-2-ynoxyphenyl)sulfonylamino]-6-(hydroxyamino)-6-oxohexyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Traditional Name: N-[5-[(4-but-2-ynoxyphenyl)sulfonylamino]-6-(hydroxyamino)-6-keto-hexyl]-3,5-dimethyl-isoxazole-4-carboxamide Formula: C22H28N4O7S MolecularWeight: 492.54532

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NC(CCCCNC(=O)C2=C(ON=C2C)C)C(=O)NO

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NC(CCCCNC(=O)C2=C(ON=C2C)C)C(=O)NO

InChI

InChI=1S/C22H28N4O7S/c1-4-5-14-32-17-9-11-18(12-10-17)34(30,31)26-19(21(27)24-29)8-6-7-13-23-22(28)20-15(2)25-33-16(20)3/h9-12,19,26,29H,6-8,13-14H2,1-3H3,(H,23,28)(H,24,27)