N-[(3-aminocarbonyl-4-ethyl-5-methyl-thiophen-2-yl)carbamothioyl]-5-bromanyl-furan-2-carboxamide

Systemtic Name: N-[(3-aminocarbonyl-4-ethyl-5-methyl-thiophen-2-yl)carbamothioyl]-5-bromanyl-furan-2-carboxamide Openeye Name: 5-bromo-N-[(3-carbamoyl-4-ethyl-5-methyl-2-thienyl)carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[(3-carbamoyl-4-ethyl-5-methyl-2-thiophenyl)amino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[(3-carbamoyl-4-ethyl-5-methyl-2-thienyl)thiocarbamoyl]-2-furamide Formula: C14H14BrN3O3S2 MolecularWeight: 416.31326

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C2=CC=C(O2)Br)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C2=CC=C(O2)Br)C

InChI

InChI=1S/C14H14BrN3O3S2/c1-3-7-6(2)23-13(10(7)11(16)19)18-14(22)17-12(20)8-4-5-9(15)21-8/h4-5H,3H2,1-2H3,(H2,16,19)(H2,17,18,20,22)