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

Systemtic Name: N-[3-cyano-6-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-phenyl-propanamide Openeye Name: N-[3-cyano-6-(2,2-dimethylpropyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-3-phenyl-propanamide CAS Name: N-[3-cyano-6-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-phenylpropanamide IUPAC Name: N-[3-cyano-6-(2,2-dimethylpropyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-phenylpropanamide Traditional Name: N-(3-cyano-6-neopentyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-phenyl-propionamide Formula: C23H28N2OS MolecularWeight: 380.54622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C23H28N2OS/c1-23(2,3)14-17-9-11-18-19(15-24)22(27-20(18)13-17)25-21(26)12-10-16-7-5-4-6-8-16/h4-8,17H,9-14H2,1-3H3,(H,25,26)