N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]-3-(2-ethoxyethoxy)benzamide

Systemtic Name: N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]-3-(2-ethoxyethoxy)benzamide Openeye Name: N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]-3-(2-ethoxyethoxy)benzamide CAS Name: N-[[3-[(2,2-dimethyl-1-oxopropyl)amino]anilino]-sulfanylidenemethyl]-3-(2-ethoxyethoxy)benzamide IUPAC Name: N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]-3-(2-ethoxyethoxy)benzamide Traditional Name: 3-(2-ethoxyethoxy)-N-[[3-(pivaloylamino)phenyl]thiocarbamoyl]benzamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C(C)(C)C

Isomeric SMILES

CCOCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C(C)(C)C

InChI

InChI=1S/C23H29N3O4S/c1-5-29-12-13-30-19-11-6-8-16(14-19)20(27)26-22(31)25-18-10-7-9-17(15-18)24-21(28)23(2,3)4/h6-11,14-15H,5,12-13H2,1-4H3,(H,24,28)(H2,25,26,27,31)