N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]heptanamide

Systemtic Name: N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]heptanamide Openeye Name: N-[3-cyano-6-(1,1-dimethylpropyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]heptanamide CAS Name: N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]heptanamide IUPAC Name: N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]heptanamide Traditional Name: N-(6-tert-amyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)enanthamide Formula: C21H32N2OS MolecularWeight: 360.55658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NC1=C(C2=C(S1)CC(CC2)C(C)(C)CC)C#N

Isomeric SMILES

CCCCCCC(=O)NC1=C(C2=C(S1)CC(CC2)C(C)(C)CC)C#N

InChI

InChI=1S/C21H32N2OS/c1-5-7-8-9-10-19(24)23-20-17(14-22)16-12-11-15(13-18(16)25-20)21(3,4)6-2/h15H,5-13H2,1-4H3,(H,23,24)