N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(4-methoxy-2-nitro-phenyl)furan-2-carboxamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(4-methoxy-2-nitro-phenyl)furan-2-carboxamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-5-(4-methoxy-2-nitro-phenyl)furan-2-carboxamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(4-methoxy-2-nitrophenyl)-2-furancarboxamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(4-methoxy-2-nitrophenyl)furan-2-carboxamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-5-(4-methoxy-2-nitro-phenyl)-2-furamide Formula: C21H17N3O5S MolecularWeight: 423.44178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=CC=C(O2)C(=O)NC3=C(C4=C(S3)CCCC4)C#N)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)C2=CC=C(O2)C(=O)NC3=C(C4=C(S3)CCCC4)C#N)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O5S/c1-28-12-6-7-14(16(10-12)24(26)27)17-8-9-18(29-17)20(25)23-21-15(11-22)13-4-2-3-5-19(13)30-21/h6-10H,2-5H2,1H3,(H,23,25)