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

Systemtic Name: 3-bromanyl-N-[[3-(ethylcarbamoyl)phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide Openeye Name: 3-bromo-N-[[3-(ethylcarbamoyl)phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide CAS Name: 3-bromo-N-[[3-(ethylcarbamoyl)anilino]-sulfanylidenemethyl]-4-(2-methoxyethoxy)benzamide IUPAC Name: 3-bromo-N-[[3-(ethylcarbamoyl)phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide Traditional Name: 3-bromo-N-[[3-(ethylcarbamoyl)phenyl]thiocarbamoyl]-4-(2-methoxyethoxy)benzamide Formula: C20H22BrN3O4S MolecularWeight: 480.37538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22BrN3O4S/c1-3-22-18(25)13-5-4-6-15(11-13)23-20(29)24-19(26)14-7-8-17(16(21)12-14)28-10-9-27-2/h4-8,11-12H,3,9-10H2,1-2H3,(H,22,25)(H2,23,24,26,29)