5-bromanyl-N-[[4-(2-ethoxyethoxy)phenyl]carbamothioyl]-2-(2-methylpropoxy)benzamide

Systemtic Name: 5-bromanyl-N-[[4-(2-ethoxyethoxy)phenyl]carbamothioyl]-2-(2-methylpropoxy)benzamide Openeye Name: 5-bromo-N-[[4-(2-ethoxyethoxy)phenyl]carbamothioyl]-2-isobutoxy-benzamide CAS Name: 5-bromo-N-[[4-(2-ethoxyethoxy)anilino]-sulfanylidenemethyl]-2-(2-methylpropoxy)benzamide IUPAC Name: 5-bromo-N-[[4-(2-ethoxyethoxy)phenyl]carbamothioyl]-2-(2-methylpropoxy)benzamide Traditional Name: 5-bromo-N-[[4-(2-ethoxyethoxy)phenyl]thiocarbamoyl]-2-isobutoxy-benzamide Formula: C22H27BrN2O4S MolecularWeight: 495.42978

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCC(C)C

Isomeric SMILES

CCOCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCC(C)C

InChI

InChI=1S/C22H27BrN2O4S/c1-4-27-11-12-28-18-8-6-17(7-9-18)24-22(30)25-21(26)19-13-16(23)5-10-20(19)29-14-15(2)3/h5-10,13,15H,4,11-12,14H2,1-3H3,(H2,24,25,26,30)