N-[3-[(5-bromanyl-2-methoxy-phenyl)carbonylcarbamothioylamino]-4-methoxy-phenyl]furan-2-carboxamide

Systemtic Name: N-[3-[(5-bromanyl-2-methoxy-phenyl)carbonylcarbamothioylamino]-4-methoxy-phenyl]furan-2-carboxamide Openeye Name: N-[3-[(5-bromo-2-methoxy-benzoyl)carbamothioylamino]-4-methoxy-phenyl]furan-2-carboxamide CAS Name: N-[3-[[[[(5-bromo-2-methoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-methoxyphenyl]-2-furancarboxamide IUPAC Name: N-[3-[(5-bromo-2-methoxybenzoyl)carbamothioylamino]-4-methoxyphenyl]furan-2-carboxamide Traditional Name: N-[3-[(5-bromo-2-methoxy-benzoyl)thiocarbamoylamino]-4-methoxy-phenyl]-2-furamide Formula: C21H18BrN3O5S MolecularWeight: 504.35372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=C(C=CC(=C2)NC(=O)C3=CC=CO3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=C(C=CC(=C2)NC(=O)C3=CC=CO3)OC

InChI

InChI=1S/C21H18BrN3O5S/c1-28-16-7-5-12(22)10-14(16)19(26)25-21(31)24-15-11-13(6-8-17(15)29-2)23-20(27)18-4-3-9-30-18/h3-11H,1-2H3,(H,23,27)(H2,24,25,26,31)