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

Systemtic Name: N-[2-methoxy-4-[(4-methoxy-3-nitro-phenyl)carbonylcarbamothioylamino]phenyl]furan-2-carboxamide Openeye Name: N-[2-methoxy-4-[(4-methoxy-3-nitro-benzoyl)carbamothioylamino]phenyl]furan-2-carboxamide CAS Name: N-[2-methoxy-4-[[[[(4-methoxy-3-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[2-methoxy-4-[(4-methoxy-3-nitrobenzoyl)carbamothioylamino]phenyl]furan-2-carboxamide Traditional Name: N-[2-methoxy-4-[(4-methoxy-3-nitro-benzoyl)thiocarbamoylamino]phenyl]-2-furamide Formula: C21H18N4O7S MolecularWeight: 470.45522

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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)OC)[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)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O7S/c1-30-16-8-5-12(10-15(16)25(28)29)19(26)24-21(33)22-13-6-7-14(18(11-13)31-2)23-20(27)17-4-3-9-32-17/h3-11H,1-2H3,(H,23,27)(H2,22,24,26,33)