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

Systemtic Name: 5-bromanyl-N-[[[4-[(4-ethoxyphenyl)amino]-4-oxidanylidene-butanoyl]amino]carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[[[4-(4-ethoxyanilino)-4-oxo-butanoyl]amino]carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[[4-(4-ethoxyanilino)-1,4-dioxobutyl]hydrazo]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[[4-(4-ethoxyanilino)-4-oxobutanoyl]amino]carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[[[4-keto-4-(p-phenetidino)butanoyl]amino]thiocarbamoyl]-2-furamide Formula: C18H19BrN4O5S MolecularWeight: 483.33626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)NNC(=S)NC(=O)C2=CC=C(O2)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)NNC(=S)NC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C18H19BrN4O5S/c1-2-27-12-5-3-11(4-6-12)20-15(24)9-10-16(25)22-23-18(29)21-17(26)13-7-8-14(19)28-13/h3-8H,2,9-10H2,1H3,(H,20,24)(H,22,25)(H2,21,23,26,29)