4-(cyanomethylsulfonylmethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide

Systemtic Name: 4-(cyanomethylsulfonylmethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide Openeye Name: 4-(cyanomethylsulfonylmethyl)-N-[3-(2-methylthiazol-4-yl)phenyl]benzamide CAS Name: 4-(cyanomethylsulfonylmethyl)-N-[3-(2-methyl-4-thiazolyl)phenyl]benzamide IUPAC Name: 4-(cyanomethylsulfonylmethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide Traditional Name: 4-(cyanomethylsulfonylmethyl)-N-[3-(2-methylthiazol-4-yl)phenyl]benzamide Formula: C20H17N3O3S2 MolecularWeight: 411.49728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)CS(=O)(=O)CC#N

Isomeric SMILES

CC1=NC(=CS1)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)CS(=O)(=O)CC#N

InChI

InChI=1S/C20H17N3O3S2/c1-14-22-19(12-27-14)17-3-2-4-18(11-17)23-20(24)16-7-5-15(6-8-16)13-28(25,26)10-9-21/h2-8,11-12H,10,13H2,1H3,(H,23,24)