5-bromanyl-N-[[2-(4-methylpiperazin-1-yl)carbonylphenyl]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[[2-(4-methylpiperazin-1-yl)carbonylphenyl]carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[[2-(4-methylpiperazine-1-carbonyl)phenyl]carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[2-[(4-methyl-1-piperazinyl)-oxomethyl]anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[2-(4-methylpiperazine-1-carbonyl)phenyl]carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[[2-(4-methylpiperazine-1-carbonyl)phenyl]thiocarbamoyl]-2-furamide Formula: C18H19BrN4O3S MolecularWeight: 451.33746

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=C(O3)Br

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C18H19BrN4O3S/c1-22-8-10-23(11-9-22)17(25)12-4-2-3-5-13(12)20-18(27)21-16(24)14-6-7-15(19)26-14/h2-7H,8-11H2,1H3,(H2,20,21,24,27)