N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,5-bis(chloranyl)-4-methoxy-benzamide

Systemtic Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,5-bis(chloranyl)-4-methoxy-benzamide Openeye Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3,5-dichloro-4-methoxy-benzamide CAS Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,5-dichloro-4-methoxybenzamide IUPAC Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,5-dichloro-4-methoxybenzamide Traditional Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3,5-dichloro-4-methoxy-benzamide Formula: C21H22Cl2N2O2S MolecularWeight: 437.38258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=C(C(=C3)Cl)OC)Cl

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=C(C(=C3)Cl)OC)Cl

InChI

InChI=1S/C21H22Cl2N2O2S/c1-21(2,3)12-5-6-13-14(10-24)20(28-17(13)9-12)25-19(26)11-7-15(22)18(27-4)16(23)8-11/h7-8,12H,5-6,9H2,1-4H3,(H,25,26)