N-[(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-5-bromanyl-furan-2-carboxamide

Systemtic Name: N-[(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-5-bromanyl-furan-2-carboxamide Openeye Name: 5-bromo-N-[(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)thiocarbamoyl]-2-furamide Formula: C15H14BrN3O3S2 MolecularWeight: 428.32396

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=S)NC(=O)C3=CC=C(O3)Br)C(=O)N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=S)NC(=O)C3=CC=C(O3)Br)C(=O)N

InChI

InChI=1S/C15H14BrN3O3S2/c16-10-6-5-8(22-10)13(21)18-15(23)19-14-11(12(17)20)7-3-1-2-4-9(7)24-14/h5-6H,1-4H2,(H2,17,20)(H2,18,19,21,23)