N-[[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamothioyl]-2,6-dimethoxy-benzamide

Systemtic Name: N-[[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamothioyl]-2,6-dimethoxy-benzamide Openeye Name: N-[[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl]carbamothioyl]-2,6-dimethoxy-benzamide CAS Name: N-[[[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-sulfanylidenemethyl]-2,6-dimethoxybenzamide IUPAC Name: N-[[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamothioyl]-2,6-dimethoxybenzamide Traditional Name: N-[[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl]thiocarbamoyl]-2,6-dimethoxy-benzamide Formula: C23H27N3O3S2 MolecularWeight: 457.60878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=S)NC(=O)C3=C(C=CC=C3OC)OC

Isomeric SMILES

CC(C)(C)[C@@H]1CCC2=C(C1)SC(=C2C#N)NC(=S)NC(=O)C3=C(C=CC=C3OC)OC

InChI

InChI=1S/C23H27N3O3S2/c1-23(2,3)13-9-10-14-15(12-24)21(31-18(14)11-13)26-22(30)25-20(27)19-16(28-4)7-6-8-17(19)29-5/h6-8,13H,9-11H2,1-5H3,(H2,25,26,27,30)/t13-/m1/s1