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

Systemtic Name: 2-[(4-methylphenoxy)methyl]-N-[2-(3-phenylpropanoylamino)cyclohexyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[(4-methylphenoxy)methyl]-N-[2-(3-phenylpropanoylamino)cyclohexyl]thiazole-4-carboxamide CAS Name: 2-[(4-methylphenoxy)methyl]-N-[2-[(1-oxo-3-phenylpropyl)amino]cyclohexyl]-4-thiazolecarboxamide IUPAC Name: 2-[(4-methylphenoxy)methyl]-N-[2-(3-phenylpropanoylamino)cyclohexyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[2-(hydrocinnamoylamino)cyclohexyl]-2-[(4-methylphenoxy)methyl]thiazole-4-carboxamide Formula: C27H31N3O3S MolecularWeight: 477.61834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=NC(=CS2)C(=O)NC3CCCCC3NC(=O)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=NC(=CS2)C(=O)NC3CCCCC3NC(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C27H31N3O3S/c1-19-11-14-21(15-12-19)33-17-26-29-24(18-34-26)27(32)30-23-10-6-5-9-22(23)28-25(31)16-13-20-7-3-2-4-8-20/h2-4,7-8,11-12,14-15,18,22-23H,5-6,9-10,13,16-17H2,1H3,(H,28,31)(H,30,32)