5-(4-chlorophenyl)-N-[[2-(3-iodanylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-N-[[2-(3-iodanylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]furan-2-carboxamide Openeye Name: 5-(4-chlorophenyl)-N-[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]furan-2-carboxamide CAS Name: 5-(4-chlorophenyl)-N-[[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(4-chlorophenyl)-N-[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]furan-2-carboxamide Traditional Name: 5-(4-chlorophenyl)-N-[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]-2-furamide Formula: C25H15ClIN3O3S MolecularWeight: 599.82737

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=CC=C(O4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC(=CC(=C1)I)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=CC=C(O4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H15ClIN3O3S/c26-16-6-4-14(5-7-16)20-10-11-22(32-20)23(31)30-25(34)28-18-8-9-21-19(13-18)29-24(33-21)15-2-1-3-17(27)12-15/h1-13H,(H2,28,30,31,34)