2-(3-chloranylphenoxy)-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide

Systemtic Name: 2-(3-chloranylphenoxy)-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide Openeye Name: 2-(3-chlorophenoxy)-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)propanamide CAS Name: 2-(3-chlorophenoxy)-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide IUPAC Name: 2-(3-chlorophenoxy)-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide Traditional Name: 2-(3-chlorophenoxy)-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)propionamide Formula: C20H21ClN2O2S MolecularWeight: 388.91094

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C(C)OC3=CC(=CC=C3)Cl

Isomeric SMILES

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C(C)OC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H21ClN2O2S/c1-3-13-7-8-16-17(11-22)20(26-18(16)9-13)23-19(24)12(2)25-15-6-4-5-14(21)10-15/h4-6,10,12-13H,3,7-9H2,1-2H3,(H,23,24)