5-(4-bromophenyl)-N-[(4-chloranyl-1,3-benzothiazol-2-yl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(4-bromophenyl)-N-[(4-chloranyl-1,3-benzothiazol-2-yl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(4-bromophenyl)-N-[(4-chloro-1,3-benzothiazol-2-yl)carbamothioyl]furan-2-carboxamide CAS Name: 5-(4-bromophenyl)-N-[[(4-chloro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(4-bromophenyl)-N-[(4-chloro-1,3-benzothiazol-2-yl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(4-bromophenyl)-N-[(4-chloro-1,3-benzothiazol-2-yl)thiocarbamoyl]-2-furamide Formula: C19H11BrClN3O2S2 MolecularWeight: 492.79654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Cl)N=C(S2)NC(=S)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC2=C(C(=C1)Cl)N=C(S2)NC(=S)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C19H11BrClN3O2S2/c20-11-6-4-10(5-7-11)13-8-9-14(26-13)17(25)23-18(27)24-19-22-16-12(21)2-1-3-15(16)28-19/h1-9H,(H2,22,23,24,25,27)