3-bromanyl-4-(2-methoxyethoxy)-N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-(2-methoxyethoxy)-N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]benzamide Openeye Name: 3-bromo-N-[(4-isopentyloxyphenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide CAS Name: 3-bromo-4-(2-methoxyethoxy)-N-[[4-(3-methylbutoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-(2-methoxyethoxy)-N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]benzamide Traditional Name: 3-bromo-N-[(4-isoamoxyphenyl)thiocarbamoyl]-4-(2-methoxyethoxy)benzamide Formula: C22H27BrN2O4S MolecularWeight: 495.42978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCCOC)Br

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCCOC)Br

InChI

InChI=1S/C22H27BrN2O4S/c1-15(2)10-11-28-18-7-5-17(6-8-18)24-22(30)25-21(26)16-4-9-20(19(23)14-16)29-13-12-27-3/h4-9,14-15H,10-13H2,1-3H3,(H2,24,25,26,30)