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

Systemtic Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-methyl-amino]-3-methyl-N-oxidanyl-3-(pyridin-3-ylmethylsulfanyl)butanamide Openeye Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-methyl-amino]-3-methyl-3-(3-pyridylmethylsulfanyl)butanehydroxamic acid CAS Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-methylamino]-N-hydroxy-3-methyl-3-(3-pyridinylmethylthio)butanamide IUPAC Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-methylamino]-N-hydroxy-3-methyl-3-(pyridin-3-ylmethylsulfanyl)butanamide Traditional Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-methyl-amino]-3-methyl-3-(3-pyridylmethylthio)butanehydroxamic acid Formula: C22H27N3O5S2 MolecularWeight: 477.59688

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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=CN=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O5S2/c1-5-6-14-30-18-9-11-19(12-10-18)32(28,29)25(4)20(21(26)24-27)22(2,3)31-16-17-8-7-13-23-15-17/h7-13,15,20,27H,14,16H2,1-4H3,(H,24,26)