(3S,6S)-4-(4-but-2-ynoxyphenyl)sulfonyl-2,2-dimethyl-6-(methylsulfonylaminomethyl)-N-oxidanyl-thiomorpholine-3-carboxamide

Systemtic Name: (3S,6S)-4-(4-but-2-ynoxyphenyl)sulfonyl-2,2-dimethyl-6-(methylsulfonylaminomethyl)-N-oxidanyl-thiomorpholine-3-carboxamide Openeye Name: (3S,6S)-4-(4-but-2-ynoxyphenyl)sulfonyl-6-(methanesulfonamidomethyl)-2,2-dimethyl-thiomorpholine-3-carbohydroxamic acid CAS Name: (3S,6S)-4-(4-but-2-ynoxyphenyl)sulfonyl-N-hydroxy-6-(methanesulfonamidomethyl)-2,2-dimethyl-3-thiomorpholinecarboxamide IUPAC Name: (3S,6S)-4-(4-but-2-ynoxyphenyl)sulfonyl-N-hydroxy-6-(methanesulfonamidomethyl)-2,2-dimethylthiomorpholine-3-carboxamide Traditional Name: (3S,6S)-4-(4-but-2-ynoxyphenyl)sulfonyl-6-(methanesulfonamidomethyl)-2,2-dimethyl-thiomorpholine-3-carbohydroxamic acid Formula: C19H27N3O7S3 MolecularWeight: 505.62858

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N2CC(SC(C2C(=O)NO)(C)C)CNS(=O)(=O)C

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N2C[C@@H](SC([C@@H]2C(=O)NO)(C)C)CNS(=O)(=O)C

InChI

InChI=1S/C19H27N3O7S3/c1-5-6-11-29-14-7-9-16(10-8-14)32(27,28)22-13-15(12-20-31(4,25)26)30-19(2,3)17(22)18(23)21-24/h7-10,15,17,20,24H,11-13H2,1-4H3,(H,21,23)/t15-,17-/m0/s1