2-bromanyl-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,4,5-trimethoxy-benzamide

Systemtic Name: 2-bromanyl-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,4,5-trimethoxy-benzamide Openeye Name: 2-bromo-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3,4,5-trimethoxy-benzamide CAS Name: 2-bromo-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,4,5-trimethoxybenzamide IUPAC Name: 2-bromo-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,4,5-trimethoxybenzamide Traditional Name: 2-bromo-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3,4,5-trimethoxy-benzamide Formula: C19H19BrN2O4S MolecularWeight: 451.33416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C#N)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C#N)Br)OC)OC

InChI

InChI=1S/C19H19BrN2O4S/c1-24-13-8-11(15(20)17(26-3)16(13)25-2)18(23)22-19-12(9-21)10-6-4-5-7-14(10)27-19/h8H,4-7H2,1-3H3,(H,22,23)