N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-[(2,5-dimethylphenyl)sulfonylamino]benzamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-[(2,5-dimethylphenyl)sulfonylamino]benzamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-[(2,5-dimethylphenyl)sulfonylamino]benzamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-4-[(2,5-dimethylphenyl)sulfonylamino]benzamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-[(2,5-dimethylphenyl)sulfonylamino]benzamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-4-[(2,5-dimethylphenyl)sulfonylamino]benzamide Formula: C25H25N3O3S2 MolecularWeight: 479.6143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C25H25N3O3S2/c1-18-7-8-19(2)24(15-18)33(30,31)28-23-11-9-20(10-12-23)25(29)27-13-14-32-17-22-6-4-3-5-21(22)16-26/h3-12,15,28H,13-14,17H2,1-2H3,(H,27,29)