N-[2-chloranyl-4-[(4-methoxy-3-nitro-phenyl)carbonylcarbamothioylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[2-chloranyl-4-[(4-methoxy-3-nitro-phenyl)carbonylcarbamothioylamino]phenyl]furan-2-carboxamide Openeye Name: N-[2-chloro-4-[(4-methoxy-3-nitro-benzoyl)carbamothioylamino]phenyl]furan-2-carboxamide CAS Name: N-[2-chloro-4-[[[[(4-methoxy-3-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[2-chloro-4-[(4-methoxy-3-nitrobenzoyl)carbamothioylamino]phenyl]furan-2-carboxamide Traditional Name: N-[2-chloro-4-[(4-methoxy-3-nitro-benzoyl)thiocarbamoylamino]phenyl]-2-furamide Formula: C20H15ClN4O6S MolecularWeight: 474.8743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CO3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CO3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H15ClN4O6S/c1-30-16-7-4-11(9-15(16)25(28)29)18(26)24-20(32)22-12-5-6-14(13(21)10-12)23-19(27)17-3-2-8-31-17/h2-10H,1H3,(H,23,27)(H2,22,24,26,32)