3-(2-ethoxyethoxy)-N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-(2-ethoxyethoxy)-N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide Openeye Name: 3-(2-ethoxyethoxy)-N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide CAS Name: 3-(2-ethoxyethoxy)-N-[[4-[(2-methyl-1-oxopropyl)amino]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-(2-ethoxyethoxy)-N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide Traditional Name: 3-(2-ethoxyethoxy)-N-[[4-(isobutyrylamino)phenyl]thiocarbamoyl]benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4S/c1-4-28-12-13-29-19-7-5-6-16(14-19)21(27)25-22(30)24-18-10-8-17(9-11-18)23-20(26)15(2)3/h5-11,14-15H,4,12-13H2,1-3H3,(H,23,26)(H2,24,25,27,30)