2-(2-cyanophenyl)sulfanyl-N-[3-(2,2-dimethylpropanoylamino)phenyl]benzamide

Systemtic Name: 2-(2-cyanophenyl)sulfanyl-N-[3-(2,2-dimethylpropanoylamino)phenyl]benzamide Openeye Name: 2-(2-cyanophenyl)sulfanyl-N-[3-(2,2-dimethylpropanoylamino)phenyl]benzamide CAS Name: 2-[(2-cyanophenyl)thio]-N-[3-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]benzamide IUPAC Name: 2-(2-cyanophenyl)sulfanyl-N-[3-(2,2-dimethylpropanoylamino)phenyl]benzamide Traditional Name: 2-[(2-cyanophenyl)thio]-N-[3-(pivaloylamino)phenyl]benzamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N

InChI

InChI=1S/C25H23N3O2S/c1-25(2,3)24(30)28-19-11-8-10-18(15-19)27-23(29)20-12-5-7-14-22(20)31-21-13-6-4-9-17(21)16-26/h4-15H,1-3H3,(H,27,29)(H,28,30)