3-bromanyl-N-[[[4-[(2,4-dichlorophenyl)amino]-4-oxidanylidene-butanoyl]amino]carbamothioyl]-4-methoxy-benzamide

Systemtic Name: 3-bromanyl-N-[[[4-[(2,4-dichlorophenyl)amino]-4-oxidanylidene-butanoyl]amino]carbamothioyl]-4-methoxy-benzamide Openeye Name: 3-bromo-N-[[[4-(2,4-dichloroanilino)-4-oxo-butanoyl]amino]carbamothioyl]-4-methoxy-benzamide CAS Name: 3-bromo-N-[[[4-(2,4-dichloroanilino)-1,4-dioxobutyl]hydrazo]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3-bromo-N-[[[4-(2,4-dichloroanilino)-4-oxobutanoyl]amino]carbamothioyl]-4-methoxybenzamide Traditional Name: 3-bromo-N-[[[4-(2,4-dichloroanilino)-4-keto-butanoyl]amino]thiocarbamoyl]-4-methoxy-benzamide Formula: C19H17BrCl2N4O4S MolecularWeight: 548.23768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)CCC(=O)NC2=C(C=C(C=C2)Cl)Cl)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)CCC(=O)NC2=C(C=C(C=C2)Cl)Cl)Br

InChI

InChI=1S/C19H17BrCl2N4O4S/c1-30-15-5-2-10(8-12(15)20)18(29)24-19(31)26-25-17(28)7-6-16(27)23-14-4-3-11(21)9-13(14)22/h2-5,8-9H,6-7H2,1H3,(H,23,27)(H,25,28)(H2,24,26,29,31)