N-[4-[(3-chloranyl-7-nitro-1-benzothiophen-2-yl)carbonylamino]-2-methoxy-phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[(3-chloranyl-7-nitro-1-benzothiophen-2-yl)carbonylamino]-2-methoxy-phenyl]furan-2-carboxamide Openeye Name: N-[4-[(3-chloro-7-nitro-benzothiophene-2-carbonyl)amino]-2-methoxy-phenyl]furan-2-carboxamide CAS Name: N-[4-[[(3-chloro-7-nitro-1-benzothiophen-2-yl)-oxomethyl]amino]-2-methoxyphenyl]-2-furancarboxamide IUPAC Name: N-[4-[(3-chloro-7-nitro-1-benzothiophene-2-carbonyl)amino]-2-methoxyphenyl]furan-2-carboxamide Traditional Name: N-[4-[(3-chloro-7-nitro-benzothiophene-2-carbonyl)amino]-2-methoxy-phenyl]-2-furamide Formula: C21H14ClN3O6S MolecularWeight: 471.87036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)C2=C(C3=C(S2)C(=CC=C3)[N+](=O)[O-])Cl)NC(=O)C4=CC=CO4

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)C2=C(C3=C(S2)C(=CC=C3)[N+](=O)[O-])Cl)NC(=O)C4=CC=CO4

InChI

InChI=1S/C21H14ClN3O6S/c1-30-16-10-11(7-8-13(16)24-20(26)15-6-3-9-31-15)23-21(27)19-17(22)12-4-2-5-14(25(28)29)18(12)32-19/h2-10H,1H3,(H,23,27)(H,24,26)