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

Systemtic Name: 2-bromanyl-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,4,5-trimethoxy-benzamide Openeye Name: 2-bromo-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3,4,5-trimethoxy-benzamide CAS Name: 2-bromo-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,4,5-trimethoxybenzamide IUPAC Name: 2-bromo-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,4,5-trimethoxybenzamide Traditional Name: 2-bromo-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3,4,5-trimethoxy-benzamide Formula: C20H21BrN2O4S MolecularWeight: 465.36074

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=C(C(=C3Br)OC)OC)OC

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=C(C(=C3Br)OC)OC)OC

InChI

InChI=1S/C20H21BrN2O4S/c1-10-5-6-11-13(9-22)20(28-15(11)7-10)23-19(24)12-8-14(25-2)17(26-3)18(27-4)16(12)21/h8,10H,5-7H2,1-4H3,(H,23,24)