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

Systemtic Name: (3S)-2,2-dimethyl-N-oxidanyl-4-(4-propylphenyl)sulfonyl-1,4-thiazepane-3-carboxamide Openeye Name: (3S)-2,2-dimethyl-4-(4-propylphenyl)sulfonyl-1,4-thiazepane-3-carbohydroxamic acid CAS Name: (3S)-N-hydroxy-2,2-dimethyl-4-(4-propylphenyl)sulfonyl-1,4-thiazepane-3-carboxamide IUPAC Name: (3S)-N-hydroxy-2,2-dimethyl-4-(4-propylphenyl)sulfonyl-1,4-thiazepane-3-carboxamide Traditional Name: (3S)-2,2-dimethyl-4-(4-propylphenyl)sulfonyl-1,4-thiazepane-3-carbohydroxamic acid Formula: C17H26N2O4S2 MolecularWeight: 386.52934

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCCSC(C2C(=O)NO)(C)C

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCCSC([C@@H]2C(=O)NO)(C)C

InChI

InChI=1S/C17H26N2O4S2/c1-4-6-13-7-9-14(10-8-13)25(22,23)19-11-5-12-24-17(2,3)15(19)16(20)18-21/h7-10,15,21H,4-6,11-12H2,1-3H3,(H,18,20)/t15-/m0/s1