3,4,5-trimethoxy-N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide Openeye Name: 3,4,5-trimethoxy-N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide CAS Name: 3,4,5-trimethoxy-N-[[3-[(2-methyl-1-oxopropyl)amino]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide Traditional Name: N-[[3-(isobutyrylamino)phenyl]thiocarbamoyl]-3,4,5-trimethoxy-benzamide Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

CC(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C21H25N3O5S/c1-12(2)19(25)22-14-7-6-8-15(11-14)23-21(30)24-20(26)13-9-16(27-3)18(29-5)17(10-13)28-4/h6-12H,1-5H3,(H,22,25)(H2,23,24,26,30)