5-bromanyl-N-[[[4-[(2,4-dichlorophenyl)amino]-4-oxidanylidene-butanoyl]amino]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[[[4-[(2,4-dichlorophenyl)amino]-4-oxidanylidene-butanoyl]amino]carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[[[4-(2,4-dichloroanilino)-4-oxo-butanoyl]amino]carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[[4-(2,4-dichloroanilino)-1,4-dioxobutyl]hydrazo]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[[4-(2,4-dichloroanilino)-4-oxobutanoyl]amino]carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[[[4-(2,4-dichloroanilino)-4-keto-butanoyl]amino]thiocarbamoyl]-2-furamide Formula: C16H13BrCl2N4O4S MolecularWeight: 508.17382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)NC(=O)CCC(=O)NNC(=S)NC(=O)C2=CC=C(O2)Br

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)NC(=O)CCC(=O)NNC(=S)NC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C16H13BrCl2N4O4S/c17-12-4-3-11(27-12)15(26)21-16(28)23-22-14(25)6-5-13(24)20-10-2-1-8(18)7-9(10)19/h1-4,7H,5-6H2,(H,20,24)(H,22,25)(H2,21,23,26,28)