3-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-N,2-bis(oxidanyl)heptanamide

Systemtic Name: 3-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-N,2-bis(oxidanyl)heptanamide Openeye Name: 3-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-2-hydroxy-heptanehydroxamic acid CAS Name: 3-[[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-oxomethyl]-N,2-dihydroxyheptanamide IUPAC Name: 3-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-N,2-dihydroxyheptanamide Traditional Name: 3-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-2-hydroxy-heptanehydroxamic acid Formula: C19H25N3O4S MolecularWeight: 391.4845

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C(=O)NO)O)C(=O)N1CCCC1C2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCCC(C(C(=O)NO)O)C(=O)N1CCCC1C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H25N3O4S/c1-2-3-7-12(16(23)17(24)21-26)19(25)22-11-6-9-14(22)18-20-13-8-4-5-10-15(13)27-18/h4-5,8,10,12,14,16,23,26H,2-3,6-7,9,11H2,1H3,(H,21,24)