N-[[[(2R)-2-(1-bromanylnaphthalen-2-yl)oxybutanoyl]amino]carbamothioyl]furan-2-carboxamide

Systemtic Name: N-[[[(2R)-2-(1-bromanylnaphthalen-2-yl)oxybutanoyl]amino]carbamothioyl]furan-2-carboxamide Openeye Name: N-[[[(2R)-2-[(1-bromo-2-naphthyl)oxy]butanoyl]amino]carbamothioyl]furan-2-carboxamide CAS Name: N-[[[(2R)-2-[(1-bromo-2-naphthalenyl)oxy]-1-oxobutyl]hydrazo]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: N-[[[(2R)-2-(1-bromonaphthalen-2-yl)oxybutanoyl]amino]carbamothioyl]furan-2-carboxamide Traditional Name: N-[[[(2R)-2-(1-bromo-2-naphthoxy)butanoyl]amino]thiocarbamoyl]-2-furamide Formula: C20H18BrN3O4S MolecularWeight: 476.34362

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NNC(=S)NC(=O)C1=CC=CO1)OC2=C(C3=CC=CC=C3C=C2)Br

Isomeric SMILES

CC[C@H](C(=O)NNC(=S)NC(=O)C1=CC=CO1)OC2=C(C3=CC=CC=C3C=C2)Br

InChI

InChI=1S/C20H18BrN3O4S/c1-2-14(28-15-10-9-12-6-3-4-7-13(12)17(15)21)19(26)23-24-20(29)22-18(25)16-8-5-11-27-16/h3-11,14H,2H2,1H3,(H,23,26)(H2,22,24,25,29)/t14-/m1/s1