4-bromanyl-N-[[3-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-3-methoxy-naphthalene-2-carboxamide

Systemtic Name: 4-bromanyl-N-[[3-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-3-methoxy-naphthalene-2-carboxamide Openeye Name: 4-bromo-N-[[3-[5-(hydroxymethyl)-2-furyl]phenyl]carbamothioyl]-3-methoxy-naphthalene-2-carboxamide CAS Name: 4-bromo-N-[[3-[5-(hydroxymethyl)-2-furanyl]anilino]-sulfanylidenemethyl]-3-methoxy-2-naphthalenecarboxamide IUPAC Name: 4-bromo-N-[[3-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-3-methoxynaphthalene-2-carboxamide Traditional Name: 4-bromo-3-methoxy-N-[[3-(5-methylol-2-furyl)phenyl]thiocarbamoyl]-2-naphthamide Formula: C24H19BrN2O4S MolecularWeight: 511.38766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2C=C1C(=O)NC(=S)NC3=CC=CC(=C3)C4=CC=C(O4)CO)Br

Isomeric SMILES

COC1=C(C2=CC=CC=C2C=C1C(=O)NC(=S)NC3=CC=CC(=C3)C4=CC=C(O4)CO)Br

InChI

InChI=1S/C24H19BrN2O4S/c1-30-22-19(12-14-5-2-3-8-18(14)21(22)25)23(29)27-24(32)26-16-7-4-6-15(11-16)20-10-9-17(13-28)31-20/h2-12,28H,13H2,1H3,(H2,26,27,29,32)