N-[(4-bromanyl-2-iodanyl-phenyl)carbamothioyl]-5-(3,4-dimethylphenyl)furan-2-carboxamide

Systemtic Name: N-[(4-bromanyl-2-iodanyl-phenyl)carbamothioyl]-5-(3,4-dimethylphenyl)furan-2-carboxamide Openeye Name: N-[(4-bromo-2-iodo-phenyl)carbamothioyl]-5-(3,4-dimethylphenyl)furan-2-carboxamide CAS Name: N-[(4-bromo-2-iodoanilino)-sulfanylidenemethyl]-5-(3,4-dimethylphenyl)-2-furancarboxamide IUPAC Name: N-[(4-bromo-2-iodophenyl)carbamothioyl]-5-(3,4-dimethylphenyl)furan-2-carboxamide Traditional Name: N-[(4-bromo-2-iodo-phenyl)thiocarbamoyl]-5-(3,4-dimethylphenyl)-2-furamide Formula: C20H16BrIN2O2S MolecularWeight: 555.22671

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=O)NC(=S)NC3=C(C=C(C=C3)Br)I)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=O)NC(=S)NC3=C(C=C(C=C3)Br)I)C

InChI

InChI=1S/C20H16BrIN2O2S/c1-11-3-4-13(9-12(11)2)17-7-8-18(26-17)19(25)24-20(27)23-16-6-5-14(21)10-15(16)22/h3-10H,1-2H3,(H2,23,24,25,27)