N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]-4-propoxy-benzamide

Systemtic Name: N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]-4-propoxy-benzamide CAS Name: N-[[3-[(2,2-dimethyl-1-oxopropyl)amino]anilino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]-4-propoxybenzamide Traditional Name: N-[[3-(pivaloylamino)phenyl]thiocarbamoyl]-4-propoxy-benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C(C)(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C(C)(C)C

InChI

InChI=1S/C22H27N3O3S/c1-5-13-28-18-11-9-15(10-12-18)19(26)25-21(29)24-17-8-6-7-16(14-17)23-20(27)22(2,3)4/h6-12,14H,5,13H2,1-4H3,(H,23,27)(H2,24,25,26,29)