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

Systemtic Name: N-[4-[(5-bromanyl-2-methoxy-3-methyl-phenyl)carbonylcarbamothioylamino]-2-chloranyl-phenyl]furan-2-carboxamide Openeye Name: N-[4-[(5-bromo-2-methoxy-3-methyl-benzoyl)carbamothioylamino]-2-chloro-phenyl]furan-2-carboxamide CAS Name: N-[4-[[[[(5-bromo-2-methoxy-3-methylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-2-chlorophenyl]-2-furancarboxamide IUPAC Name: N-[4-[(5-bromo-2-methoxy-3-methylbenzoyl)carbamothioylamino]-2-chlorophenyl]furan-2-carboxamide Traditional Name: N-[4-[(5-bromo-2-methoxy-3-methyl-benzoyl)thiocarbamoylamino]-2-chloro-phenyl]-2-furamide Formula: C21H17BrClN3O4S MolecularWeight: 522.79938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CO3)Cl)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CO3)Cl)OC

InChI

InChI=1S/C21H17BrClN3O4S/c1-11-8-12(22)9-14(18(11)29-2)19(27)26-21(31)24-13-5-6-16(15(23)10-13)25-20(28)17-4-3-7-30-17/h3-10H,1-2H3,(H,25,28)(H2,24,26,27,31)