2-[(2-heptylsulfanyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-oxidanyl-3-(4-phenylmethoxyphenyl)propanamide

Systemtic Name: 2-[(2-heptylsulfanyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-oxidanyl-3-(4-phenylmethoxyphenyl)propanamide Openeye Name: 3-(4-benzyloxyphenyl)-2-[(2-heptylsulfanyl-1,3-benzothiazol-6-yl)sulfonylamino]propanehydroxamic acid CAS Name: 2-[[2-(heptylthio)-1,3-benzothiazol-6-yl]sulfonylamino]-N-hydroxy-3-(4-phenylmethoxyphenyl)propanamide IUPAC Name: 2-[(2-heptylsulfanyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-hydroxy-3-(4-phenylmethoxyphenyl)propanamide Traditional Name: 3-(4-benzoxyphenyl)-2-[[2-(heptylthio)-1,3-benzothiazol-6-yl]sulfonylamino]propanehydroxamic acid Formula: C30H35N3O5S3 MolecularWeight: 613.811

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NC(CC3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)NO

Isomeric SMILES

CCCCCCCSC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NC(CC3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)NO

InChI

InChI=1S/C30H35N3O5S3/c1-2-3-4-5-9-18-39-30-31-26-17-16-25(20-28(26)40-30)41(36,37)33-27(29(34)32-35)19-22-12-14-24(15-13-22)38-21-23-10-7-6-8-11-23/h6-8,10-17,20,27,33,35H,2-5,9,18-19,21H2,1H3,(H,32,34)