N-[[3-chloranyl-4-(furan-2-ylcarbonylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[[3-chloranyl-4-(furan-2-ylcarbonylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: N-[[3-chloro-4-(furan-2-carbonylamino)phenyl]carbamothioyl]benzofuran-2-carboxamide CAS Name: N-[[3-chloro-4-[[2-furanyl(oxo)methyl]amino]anilino]-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: N-[[3-chloro-4-(furan-2-carbonylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: N-[[3-chloro-4-(2-furoylamino)phenyl]thiocarbamoyl]coumarilamide Formula: C21H14ClN3O4S MolecularWeight: 439.87156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(=O)NC(=S)NC3=CC(=C(C=C3)NC(=O)C4=CC=CO4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)NC(=S)NC3=CC(=C(C=C3)NC(=O)C4=CC=CO4)Cl

InChI

InChI=1S/C21H14ClN3O4S/c22-14-11-13(7-8-15(14)24-19(26)17-6-3-9-28-17)23-21(30)25-20(27)18-10-12-4-1-2-5-16(12)29-18/h1-11H,(H,24,26)(H2,23,25,27,30)