N-[3-cyano-4-(3,4-dimethoxyphenyl)thiophen-2-yl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[3-cyano-4-(3,4-dimethoxyphenyl)thiophen-2-yl]-5-nitro-furan-2-carboxamide Openeye Name: N-[3-cyano-4-(3,4-dimethoxyphenyl)-2-thienyl]-5-nitro-furan-2-carboxamide CAS Name: N-[3-cyano-4-(3,4-dimethoxyphenyl)-2-thiophenyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[3-cyano-4-(3,4-dimethoxyphenyl)thiophen-2-yl]-5-nitrofuran-2-carboxamide Traditional Name: N-[3-cyano-4-(3,4-dimethoxyphenyl)-2-thienyl]-5-nitro-2-furamide Formula: C18H13N3O6S MolecularWeight: 399.37732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=C2C#N)NC(=O)C3=CC=C(O3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=C2C#N)NC(=O)C3=CC=C(O3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H13N3O6S/c1-25-13-4-3-10(7-15(13)26-2)12-9-28-18(11(12)8-19)20-17(22)14-5-6-16(27-14)21(23)24/h3-7,9H,1-2H3,(H,20,22)