2-[(3,5-dimethylphenoxy)methyl]-N-[2-(2-methylpropanoylamino)cyclohexyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[2-(2-methylpropanoylamino)cyclohexyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[2-(2-methylpropanoylamino)cyclohexyl]thiazole-4-carboxamide CAS Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[2-[(2-methyl-1-oxopropyl)amino]cyclohexyl]-4-thiazolecarboxamide IUPAC Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[2-(2-methylpropanoylamino)cyclohexyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[2-(isobutyrylamino)cyclohexyl]thiazole-4-carboxamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC2=NC(=CS2)C(=O)NC3CCCCC3NC(=O)C(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC2=NC(=CS2)C(=O)NC3CCCCC3NC(=O)C(C)C)C

InChI

InChI=1S/C23H31N3O3S/c1-14(2)22(27)25-18-7-5-6-8-19(18)26-23(28)20-13-30-21(24-20)12-29-17-10-15(3)9-16(4)11-17/h9-11,13-14,18-19H,5-8,12H2,1-4H3,(H,25,27)(H,26,28)