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

Systemtic Name: 4-(4-chloranyl-3,5-dimethyl-phenoxy)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)butanamide Openeye Name: 4-(4-chloro-3,5-dimethyl-phenoxy)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)butanamide CAS Name: 4-(4-chloro-3,5-dimethylphenoxy)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)butanamide IUPAC Name: 4-(4-chloro-3,5-dimethylphenoxy)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)butanamide Traditional Name: 4-(4-chloro-3,5-dimethyl-phenoxy)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)butyramide Formula: C21H23ClN2O2S MolecularWeight: 402.93752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCCCC(=O)NC2=C(C3=C(S2)CCCC3)C#N

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCCCC(=O)NC2=C(C3=C(S2)CCCC3)C#N

InChI

InChI=1S/C21H23ClN2O2S/c1-13-10-15(11-14(2)20(13)22)26-9-5-8-19(25)24-21-17(12-23)16-6-3-4-7-18(16)27-21/h10-11H,3-9H2,1-2H3,(H,24,25)