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

Systemtic Name: N-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-2-(2-propan-2-ylphenoxy)ethanamide Openeye Name: N-[(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamothioyl]-2-(2-isopropylphenoxy)acetamide CAS Name: N-[[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-sulfanylidenemethyl]-2-(2-propan-2-ylphenoxy)acetamide IUPAC Name: N-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-2-(2-propan-2-ylphenoxy)acetamide Traditional Name: N-[(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)thiocarbamoyl]-2-(2-isopropylphenoxy)acetamide Formula: C22H25N3O2S2 MolecularWeight: 427.5828

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=S)NC(=O)COC3=CC=CC=C3C(C)C

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC(=S)NC(=O)COC3=CC=CC=C3C(C)C

InChI

InChI=1S/C22H25N3O2S2/c1-13(2)15-6-4-5-7-18(15)27-12-20(26)24-22(28)25-21-17(11-23)16-9-8-14(3)10-19(16)29-21/h4-7,13-14H,8-10,12H2,1-3H3,(H2,24,25,26,28)