5-bromanyl-N-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[4-[(4-methyl-1-piperidinyl)sulfonyl]anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[[4-(4-methylpiperidino)sulfonylphenyl]thiocarbamoyl]-2-furamide Formula: C18H20BrN3O4S2 MolecularWeight: 486.4031

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(O3)Br

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C18H20BrN3O4S2/c1-12-8-10-22(11-9-12)28(24,25)14-4-2-13(3-5-14)20-18(27)21-17(23)15-6-7-16(19)26-15/h2-7,12H,8-11H2,1H3,(H2,20,21,23,27)