2-[(4-but-2-ynoxyphenyl)sulfonyl-methyl-amino]-3-methyl-N-oxidanyl-3-(phenylmethylsulfanyl)butanamide

Systemtic Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-methyl-amino]-3-methyl-N-oxidanyl-3-(phenylmethylsulfanyl)butanamide Openeye Name: 3-benzylsulfanyl-2-[(4-but-2-ynoxyphenyl)sulfonyl-methyl-amino]-3-methyl-butanehydroxamic acid CAS Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-methylamino]-N-hydroxy-3-methyl-3-(phenylmethylthio)butanamide IUPAC Name: 3-benzylsulfanyl-2-[(4-but-2-ynoxyphenyl)sulfonyl-methylamino]-N-hydroxy-3-methylbutanamide Traditional Name: 3-(benzylthio)-2-[(4-but-2-ynoxyphenyl)sulfonyl-methyl-amino]-3-methyl-butanehydroxamic acid Formula: C23H28N2O5S2 MolecularWeight: 476.60882

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N(C)C(C(=O)NO)C(C)(C)SCC2=CC=CC=C2

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N(C)C(C(=O)NO)C(C)(C)SCC2=CC=CC=C2

InChI

InChI=1S/C23H28N2O5S2/c1-5-6-16-30-19-12-14-20(15-13-19)32(28,29)25(4)21(22(26)24-27)23(2,3)31-17-18-10-8-7-9-11-18/h7-15,21,27H,16-17H2,1-4H3,(H,24,26)