5-bromanyl-N-[(4-hexoxyphenyl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[(4-hexoxyphenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[(4-hexoxyphenyl)carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[(4-hexoxyanilino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[(4-hexoxyphenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[(4-hexoxyphenyl)thiocarbamoyl]-2-furamide Formula: C18H21BrN2O3S MolecularWeight: 425.33994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(O2)Br

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C18H21BrN2O3S/c1-2-3-4-5-12-23-14-8-6-13(7-9-14)20-18(25)21-17(22)15-10-11-16(19)24-15/h6-11H,2-5,12H2,1H3,(H2,20,21,22,25)