N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-[(2-nitrophenoxy)methyl]furan-2-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(O3)COC4=CC=CC=C4[N+](=O)[O-])C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(O3)COC4=CC=CC=C4[N+](=O)[O-])C#N

InChI

InChI=1S/C21H17N3O5S/c22-11-15-14-5-1-4-8-19(14)30-21(15)23-20(25)18-10-9-13(29-18)12-28-17-7-3-2-6-16(17)24(26)27/h2-3,6-7,9-10H,1,4-5,8,12H2,(H,23,25)