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

Systemtic Name: N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(4-propylpiperazin-1-yl)ethanamide Openeye Name: N-[3-cyano-6-(1,1-dimethylpropyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-(4-propylpiperazin-1-yl)acetamide CAS Name: N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(4-propyl-1-piperazinyl)acetamide IUPAC Name: N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(4-propylpiperazin-1-yl)acetamide Traditional Name: N-(6-tert-amyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(4-propylpiperazino)acetamide Formula: C23H36N4OS MolecularWeight: 416.62314

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)CC(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)CC)C#N

Isomeric SMILES

CCCN1CCN(CC1)CC(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)CC)C#N

InChI

InChI=1S/C23H36N4OS/c1-5-9-26-10-12-27(13-11-26)16-21(28)25-22-19(15-24)18-8-7-17(14-20(18)29-22)23(3,4)6-2/h17H,5-14,16H2,1-4H3,(H,25,28)