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

Systemtic Name: N-[2-(1-adamantylcarbamoylamino)cyclohexyl]-2-[(3,5-dimethylphenoxy)methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-[2-(1-adamantylcarbamoylamino)cyclohexyl]-2-[(3,5-dimethylphenoxy)methyl]thiazole-4-carboxamide CAS Name: N-[2-[[(1-adamantylamino)-oxomethyl]amino]cyclohexyl]-2-[(3,5-dimethylphenoxy)methyl]-4-thiazolecarboxamide IUPAC Name: N-[2-(1-adamantylcarbamoylamino)cyclohexyl]-2-[(3,5-dimethylphenoxy)methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[2-(1-adamantylcarbamoylamino)cyclohexyl]-2-[(3,5-dimethylphenoxy)methyl]thiazole-4-carboxamide Formula: C30H40N4O3S MolecularWeight: 536.7286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC2=NC(=CS2)C(=O)NC3CCCCC3NC(=O)NC45CC6CC(C4)CC(C6)C5)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC2=NC(=CS2)C(=O)NC3CCCCC3NC(=O)NC45CC6CC(C4)CC(C6)C5)C

InChI

InChI=1S/C30H40N4O3S/c1-18-7-19(2)9-23(8-18)37-16-27-31-26(17-38-27)28(35)32-24-5-3-4-6-25(24)33-29(36)34-30-13-20-10-21(14-30)12-22(11-20)15-30/h7-9,17,20-22,24-25H,3-6,10-16H2,1-2H3,(H,32,35)(H2,33,34,36)