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

Systemtic Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[2-(heptanoylamino)cyclohexyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[2-(heptanoylamino)cyclohexyl]thiazole-4-carboxamide CAS Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[2-(1-oxoheptylamino)cyclohexyl]-4-thiazolecarboxamide IUPAC Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[2-(heptanoylamino)cyclohexyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[2-(enanthylamino)cyclohexyl]thiazole-4-carboxamide Formula: C26H37N3O3S MolecularWeight: 471.65528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NC1CCCCC1NC(=O)C2=CSC(=N2)COC3=CC(=CC(=C3)C)C

Isomeric SMILES

CCCCCCC(=O)NC1CCCCC1NC(=O)C2=CSC(=N2)COC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C26H37N3O3S/c1-4-5-6-7-12-24(30)27-21-10-8-9-11-22(21)29-26(31)23-17-33-25(28-23)16-32-20-14-18(2)13-19(3)15-20/h13-15,17,21-22H,4-12,16H2,1-3H3,(H,27,30)(H,29,31)