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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCCOC)Br

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCCOC)Br

InChI

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