N-[3-cyano-6-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-methyl-butanamide

Systemtic Name: N-[3-cyano-6-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-methyl-butanamide Openeye Name: N-[3-cyano-6-(2,2-dimethylpropyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-3-methyl-butanamide CAS Name: N-[3-cyano-6-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-methylbutanamide IUPAC Name: N-[3-cyano-6-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-methylbutanamide Traditional Name: N-(3-cyano-6-neopentyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-methyl-butyramide Formula: C19H28N2OS MolecularWeight: 332.50342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N2OS/c1-12(2)8-17(22)21-18-15(11-20)14-7-6-13(9-16(14)23-18)10-19(3,4)5/h12-13H,6-10H2,1-5H3,(H,21,22)