N-[[3-[(3-chlorophenyl)carbonylamino]phenyl]carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide

Systemtic Name: N-[[3-[(3-chlorophenyl)carbonylamino]phenyl]carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide Openeye Name: N-[[3-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide CAS Name: N-[[3-[[(3-chlorophenyl)-oxomethyl]amino]anilino]-sulfanylidenemethyl]-5-(2-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[[3-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide Traditional Name: N-[[3-[(3-chlorobenzoyl)amino]phenyl]thiocarbamoyl]-5-(2-nitrophenyl)-2-furamide Formula: C25H17ClN4O5S MolecularWeight: 520.94428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(O2)C(=O)NC(=S)NC3=CC=CC(=C3)NC(=O)C4=CC(=CC=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(O2)C(=O)NC(=S)NC3=CC=CC(=C3)NC(=O)C4=CC(=CC=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C25H17ClN4O5S/c26-16-6-3-5-15(13-16)23(31)27-17-7-4-8-18(14-17)28-25(36)29-24(32)22-12-11-21(35-22)19-9-1-2-10-20(19)30(33)34/h1-14H,(H,27,31)(H2,28,29,32,36)