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

Systemtic Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(2-phenylpropan-2-yl)phenoxy]ethanamide Openeye Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[4-(1-methyl-1-phenyl-ethyl)phenoxy]acetamide CAS Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(2-phenylpropan-2-yl)phenoxy]acetamide IUPAC Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(2-phenylpropan-2-yl)phenoxy]acetamide Traditional Name: 2-(4-cumylphenoxy)-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide Formula: C27H28N2O2S MolecularWeight: 444.58842

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)COC3=CC=C(C=C3)C(C)(C)C4=CC=CC=C4

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)COC3=CC=C(C=C3)C(C)(C)C4=CC=CC=C4

InChI

InChI=1S/C27H28N2O2S/c1-18-9-14-22-23(16-28)26(32-24(22)15-18)29-25(30)17-31-21-12-10-20(11-13-21)27(2,3)19-7-5-4-6-8-19/h4-8,10-13,18H,9,14-15,17H2,1-3H3,(H,29,30)