2-(3-bromophenyl)-2-(4-but-2-ynoxyphenyl)-N-oxidanyl-2-sulfanyl-ethanamide

Systemtic Name: 2-(3-bromophenyl)-2-(4-but-2-ynoxyphenyl)-N-oxidanyl-2-sulfanyl-ethanamide Openeye Name: 2-(3-bromophenyl)-2-(4-but-2-ynoxyphenyl)-2-sulfanyl-ethanehydroxamic acid CAS Name: 2-(3-bromophenyl)-2-(4-but-2-ynoxyphenyl)-N-hydroxy-2-mercaptoacetamide IUPAC Name: 2-(3-bromophenyl)-2-(4-but-2-ynoxyphenyl)-N-hydroxy-2-sulfanylacetamide Traditional Name: 2-(3-bromophenyl)-2-(4-but-2-ynoxyphenyl)-2-mercapto-ethanehydroxamic acid Formula: C18H16BrNO3S MolecularWeight: 406.29354

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)C(C2=CC(=CC=C2)Br)(C(=O)NO)S

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)C(C2=CC(=CC=C2)Br)(C(=O)NO)S

InChI

InChI=1S/C18H16BrNO3S/c1-2-3-11-23-16-9-7-13(8-10-16)18(24,17(21)20-22)14-5-4-6-15(19)12-14/h4-10,12,22,24H,11H2,1H3,(H,20,21)