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

Systemtic Name: N-[[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamothioyl]-2-naphthalen-1-yl-ethanamide Openeye Name: N-[[3-cyano-6-(1,1-dimethylpropyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]carbamothioyl]-2-(1-naphthyl)acetamide CAS Name: N-[[[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-sulfanylidenemethyl]-2-(1-naphthalenyl)acetamide IUPAC Name: N-[[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamothioyl]-2-naphthalen-1-ylacetamide Traditional Name: N-[(6-tert-amyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)thiocarbamoyl]-2-(1-naphthyl)acetamide Formula: C27H29N3OS2 MolecularWeight: 475.66866

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=S)NC(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=S)NC(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H29N3OS2/c1-4-27(2,3)19-12-13-21-22(16-28)25(33-23(21)15-19)30-26(32)29-24(31)14-18-10-7-9-17-8-5-6-11-20(17)18/h5-11,19H,4,12-15H2,1-3H3,(H2,29,30,31,32)