4-(4-but-2-ynoxyphenyl)sulfonyl-N1-[(E)-hex-3-en-1,5-diynyl]-N3-oxidanyl-1,4-diazepane-1,3-dicarboxamide

Systemtic Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-N1-[(E)-hex-3-en-1,5-diynyl]-N3-oxidanyl-1,4-diazepane-1,3-dicarboxamide Openeye Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-N-[(E)-hex-3-en-1,5-diynyl]-3-(hydroxycarbamoyl)-1,4-diazepane-1-carboxamide CAS Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-N1-[(E)-hex-3-en-1,5-diynyl]-N3-hydroxy-1,4-diazepane-1,3-dicarboxamide IUPAC Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-1-N-[(E)-hex-3-en-1,5-diynyl]-3-N-hydroxy-1,4-diazepane-1,3-dicarboxamide Traditional Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-N-[(E)-hex-3-en-1,5-diynyl]-3-(hydroxycarbamoyl)-1,4-diazepane-1-carboxamide Formula: C23H24N4O6S MolecularWeight: 484.52486

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2C(=O)NO)C(=O)NC#CC=CC#C

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2C(=O)NO)C(=O)NC#C/C=C/C#C

InChI

InChI=1S/C23H24N4O6S/c1-3-5-7-8-14-24-23(29)26-15-9-16-27(21(18-26)22(28)25-30)34(31,32)20-12-10-19(11-13-20)33-17-6-4-2/h1,5,7,10-13,21,30H,9,15-18H2,2H3,(H,24,29)(H,25,28)/b7-5+