N-[3-(2,2-dimethylpropanoylamino)phenyl]-2-(1,3-thiazol-4-ylmethylsulfanyl)benzamide

Systemtic Name: N-[3-(2,2-dimethylpropanoylamino)phenyl]-2-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Openeye Name: N-[3-(2,2-dimethylpropanoylamino)phenyl]-2-(thiazol-4-ylmethylsulfanyl)benzamide CAS Name: N-[3-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]-2-(4-thiazolylmethylthio)benzamide IUPAC Name: N-[3-(2,2-dimethylpropanoylamino)phenyl]-2-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Traditional Name: N-[3-(pivaloylamino)phenyl]-2-(thiazol-4-ylmethylthio)benzamide Formula: C22H23N3O2S2 MolecularWeight: 425.56692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2SCC3=CSC=N3

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2SCC3=CSC=N3

InChI

InChI=1S/C22H23N3O2S2/c1-22(2,3)21(27)25-16-8-6-7-15(11-16)24-20(26)18-9-4-5-10-19(18)29-13-17-12-28-14-23-17/h4-12,14H,13H2,1-3H3,(H,24,26)(H,25,27)