N-[4-(cyanomethyl)phenyl]-3-[(2,5-dimethylphenyl)sulfonylamino]benzamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-3-[(2,5-dimethylphenyl)sulfonylamino]benzamide Openeye Name: N-[4-(cyanomethyl)phenyl]-3-[(2,5-dimethylphenyl)sulfonylamino]benzamide CAS Name: N-[4-(cyanomethyl)phenyl]-3-[(2,5-dimethylphenyl)sulfonylamino]benzamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-3-[(2,5-dimethylphenyl)sulfonylamino]benzamide Traditional Name: N-[4-(cyanomethyl)phenyl]-3-[(2,5-dimethylphenyl)sulfonylamino]benzamide Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C23H21N3O3S/c1-16-6-7-17(2)22(14-16)30(28,29)26-21-5-3-4-19(15-21)23(27)25-20-10-8-18(9-11-20)12-13-24/h3-11,14-15,26H,12H2,1-2H3,(H,25,27)