N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(2,5-dimethylphenoxy)butanamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(2,5-dimethylphenoxy)butanamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-(2,5-dimethylphenoxy)butanamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(2,5-dimethylphenoxy)butanamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(2,5-dimethylphenoxy)butanamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-(2,5-dimethylphenoxy)butyramide Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCCC(=O)NC2=C(C3=C(S2)CCCC3)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCCC(=O)NC2=C(C3=C(S2)CCCC3)C#N

InChI

InChI=1S/C21H24N2O2S/c1-14-9-10-15(2)18(12-14)25-11-5-8-20(24)23-21-17(13-22)16-6-3-4-7-19(16)26-21/h9-10,12H,3-8,11H2,1-2H3,(H,23,24)