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

Systemtic Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[4-(3-phenylpropanoylamino)cyclohexyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[4-(3-phenylpropanoylamino)cyclohexyl]thiazole-4-carboxamide CAS Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[4-[(1-oxo-3-phenylpropyl)amino]cyclohexyl]-4-thiazolecarboxamide IUPAC Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[4-(3-phenylpropanoylamino)cyclohexyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[4-(hydrocinnamoylamino)cyclohexyl]thiazole-4-carboxamide Formula: C28H33N3O3S MolecularWeight: 491.64492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC2=NC(=CS2)C(=O)NC3CCC(CC3)NC(=O)CCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC2=NC(=CS2)C(=O)NC3CCC(CC3)NC(=O)CCC4=CC=CC=C4)C

InChI

InChI=1S/C28H33N3O3S/c1-19-14-20(2)16-24(15-19)34-17-27-31-25(18-35-27)28(33)30-23-11-9-22(10-12-23)29-26(32)13-8-21-6-4-3-5-7-21/h3-7,14-16,18,22-23H,8-13,17H2,1-2H3,(H,29,32)(H,30,33)