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

Systemtic Name: 4-(2-ethoxyethoxy)-N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide Openeye Name: 4-(2-ethoxyethoxy)-N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide CAS Name: 4-(2-ethoxyethoxy)-N-[[4-[(2-methyl-1-oxopropyl)amino]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-(2-ethoxyethoxy)-N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide Traditional Name: 4-(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=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C(C)C

Isomeric SMILES

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

InChI

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