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

Systemtic Name: 2-[(2-heptylsulfanyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-oxidanyl-3-(4-prop-2-enoxyphenyl)propanamide Openeye Name: 3-(4-allyloxyphenyl)-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-prop-2-enoxyphenyl)propanamide IUPAC Name: 2-[(2-heptylsulfanyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-hydroxy-3-(4-prop-2-enoxyphenyl)propanamide Traditional Name: 3-(4-allyloxyphenyl)-2-[[2-(heptylthio)-1,3-benzothiazol-6-yl]sulfonylamino]propanehydroxamic acid Formula: C26H33N3O5S3 MolecularWeight: 563.75232

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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)OCC=C)C(=O)NO

Isomeric SMILES

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

InChI

InChI=1S/C26H33N3O5S3/c1-3-5-6-7-8-16-35-26-27-22-14-13-21(18-24(22)36-26)37(32,33)29-23(25(30)28-31)17-19-9-11-20(12-10-19)34-15-4-2/h4,9-14,18,23,29,31H,2-3,5-8,15-17H2,1H3,(H,28,30)