5-bromanyl-N-[[2-[(4-ethoxyphenyl)carbamoyl]phenyl]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[[2-[(4-ethoxyphenyl)carbamoyl]phenyl]carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[[2-[(4-ethoxyphenyl)carbamoyl]phenyl]carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[2-[(4-ethoxyanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[2-[(4-ethoxyphenyl)carbamoyl]phenyl]carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[[2-(p-phenetylcarbamoyl)phenyl]thiocarbamoyl]-2-furamide Formula: C21H18BrN3O4S MolecularWeight: 488.35432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=C(O3)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C21H18BrN3O4S/c1-2-28-14-9-7-13(8-10-14)23-19(26)15-5-3-4-6-16(15)24-21(30)25-20(27)17-11-12-18(22)29-17/h3-12H,2H2,1H3,(H,23,26)(H2,24,25,27,30)