(3S)-2,2-dimethyl-N-oxidanyl-4-(4-pyridin-4-yloxyphenyl)sulfonyl-1,4-thiazepane-3-carboxamide

Systemtic Name: (3S)-2,2-dimethyl-N-oxidanyl-4-(4-pyridin-4-yloxyphenyl)sulfonyl-1,4-thiazepane-3-carboxamide Openeye Name: (3S)-2,2-dimethyl-4-[4-(4-pyridyloxy)phenyl]sulfonyl-1,4-thiazepane-3-carbohydroxamic acid CAS Name: (3S)-N-hydroxy-2,2-dimethyl-4-(4-pyridin-4-yloxyphenyl)sulfonyl-1,4-thiazepane-3-carboxamide IUPAC Name: (3S)-N-hydroxy-2,2-dimethyl-4-(4-pyridin-4-yloxyphenyl)sulfonyl-1,4-thiazepane-3-carboxamide Traditional Name: (3S)-2,2-dimethyl-4-[4-(4-pyridyloxy)phenyl]sulfonyl-1,4-thiazepane-3-carbohydroxamic acid Formula: C19H23N3O5S2 MolecularWeight: 437.53302

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CCCS1)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=NC=C3)C(=O)NO)C

Isomeric SMILES

CC1([C@@H](N(CCCS1)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=NC=C3)C(=O)NO)C

InChI

InChI=1S/C19H23N3O5S2/c1-19(2)17(18(23)21-24)22(12-3-13-28-19)29(25,26)16-6-4-14(5-7-16)27-15-8-10-20-11-9-15/h4-11,17,24H,3,12-13H2,1-2H3,(H,21,23)/t17-/m0/s1