2-(4-but-2-ynoxyphenyl)sulfanyl-N-oxidanyl-6-(4-thiophen-2-ylbutanoylamino)hexanamide

Systemtic Name: 2-(4-but-2-ynoxyphenyl)sulfanyl-N-oxidanyl-6-(4-thiophen-2-ylbutanoylamino)hexanamide Openeye Name: N-[5-(4-but-2-ynoxyphenyl)sulfanyl-6-(hydroxyamino)-6-oxo-hexyl]-4-(2-thienyl)butanamide CAS Name: 2-[(4-but-2-ynoxyphenyl)thio]-N-hydroxy-6-[(1-oxo-4-thiophen-2-ylbutyl)amino]hexanamide IUPAC Name: 2-(4-but-2-ynoxyphenyl)sulfanyl-N-hydroxy-6-(4-thiophen-2-ylbutanoylamino)hexanamide Traditional Name: N-[5-[(4-but-2-ynoxyphenyl)thio]-6-(hydroxyamino)-6-keto-hexyl]-4-(2-thienyl)butyramide Formula: C24H30N2O4S2 MolecularWeight: 474.636

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)SC(CCCCNC(=O)CCCC2=CC=CS2)C(=O)NO

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)SC(CCCCNC(=O)CCCC2=CC=CS2)C(=O)NO

InChI

InChI=1S/C24H30N2O4S2/c1-2-3-17-30-19-12-14-21(15-13-19)32-22(24(28)26-29)10-4-5-16-25-23(27)11-6-8-20-9-7-18-31-20/h7,9,12-15,18,22,29H,4-6,8,10-11,16-17H2,1H3,(H,25,27)(H,26,28)