5-bromanyl-N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[(3-isopentyloxyphenyl)carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[3-(3-methylbutoxy)anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[(3-isoamoxyphenyl)thiocarbamoyl]-2-furamide Formula: C17H19BrN2O3S MolecularWeight: 411.31336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC=C(O2)Br

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C17H19BrN2O3S/c1-11(2)8-9-22-13-5-3-4-12(10-13)19-17(24)20-16(21)14-6-7-15(18)23-14/h3-7,10-11H,8-9H2,1-2H3,(H2,19,20,21,24)