N-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-4-[(2,4-dimethylphenyl)sulfonylamino]benzamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-4-[(2,4-dimethylphenyl)sulfonylamino]benzamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]-4-[(2,4-dimethylphenyl)sulfonylamino]benzamide CAS Name: N-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-4-[(2,4-dimethylphenyl)sulfonylamino]benzamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-4-[(2,4-dimethylphenyl)sulfonylamino]benzamide Traditional Name: 4-[(2,4-dimethylphenyl)sulfonylamino]-N-[2-keto-2-(piperonylamino)ethyl]benzamide Formula: C25H25N3O6S MolecularWeight: 495.5475

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NCC(=O)NCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NCC(=O)NCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C25H25N3O6S/c1-16-3-10-23(17(2)11-16)35(31,32)28-20-7-5-19(6-8-20)25(30)27-14-24(29)26-13-18-4-9-21-22(12-18)34-15-33-21/h3-12,28H,13-15H2,1-2H3,(H,26,29)(H,27,30)