1-(4-but-2-ynoxyphenyl)sulfonyl-N-oxidanyl-4-propylsulfonyl-1,4-diazepane-2-carboxamide

Systemtic Name: 1-(4-but-2-ynoxyphenyl)sulfonyl-N-oxidanyl-4-propylsulfonyl-1,4-diazepane-2-carboxamide Openeye Name: 1-(4-but-2-ynoxyphenyl)sulfonyl-4-propylsulfonyl-1,4-diazepane-2-carbohydroxamic acid CAS Name: 1-(4-but-2-ynoxyphenyl)sulfonyl-N-hydroxy-4-propylsulfonyl-1,4-diazepane-2-carboxamide IUPAC Name: 1-(4-but-2-ynoxyphenyl)sulfonyl-N-hydroxy-4-propylsulfonyl-1,4-diazepane-2-carboxamide Traditional Name: 1-(4-but-2-ynoxyphenyl)sulfonyl-4-propylsulfonyl-1,4-diazepane-2-carbohydroxamic acid Formula: C19H27N3O7S2 MolecularWeight: 473.56358

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCN(C(C1)C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OCC#CC

Isomeric SMILES

CCCS(=O)(=O)N1CCCN(C(C1)C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OCC#CC

InChI

InChI=1S/C19H27N3O7S2/c1-3-5-13-29-16-7-9-17(10-8-16)31(27,28)22-12-6-11-21(30(25,26)14-4-2)15-18(22)19(23)20-24/h7-10,18,24H,4,6,11-15H2,1-2H3,(H,20,23)