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

Systemtic Name: 5-[(4-bromanyl-2-chloranyl-phenoxy)methyl]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)furan-2-carboxamide Openeye Name: 5-[(4-bromo-2-chloro-phenoxy)methyl]-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)furan-2-carboxamide CAS Name: 5-[(4-bromo-2-chlorophenoxy)methyl]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-furancarboxamide IUPAC Name: 5-[(4-bromo-2-chlorophenoxy)methyl]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)furan-2-carboxamide Traditional Name: 5-[(4-bromo-2-chloro-phenoxy)methyl]-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-furamide Formula: C21H16BrClN2O3S MolecularWeight: 491.78534

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(O3)COC4=C(C=C(C=C4)Br)Cl)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(O3)COC4=C(C=C(C=C4)Br)Cl)C#N

InChI

InChI=1S/C21H16BrClN2O3S/c22-12-5-7-17(16(23)9-12)27-11-13-6-8-18(28-13)20(26)25-21-15(10-24)14-3-1-2-4-19(14)29-21/h5-9H,1-4,11H2,(H,25,26)