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

Systemtic Name: N-[2-(3-cyclopentylpropanoylamino)ethyl]-2-[(3,5-dimethylphenoxy)methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-[2-(3-cyclopentylpropanoylamino)ethyl]-2-[(3,5-dimethylphenoxy)methyl]thiazole-4-carboxamide CAS Name: N-[2-[(3-cyclopentyl-1-oxopropyl)amino]ethyl]-2-[(3,5-dimethylphenoxy)methyl]-4-thiazolecarboxamide IUPAC Name: N-[2-(3-cyclopentylpropanoylamino)ethyl]-2-[(3,5-dimethylphenoxy)methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[2-(3-cyclopentylpropanoylamino)ethyl]-2-[(3,5-dimethylphenoxy)methyl]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)NCCNC(=O)CCC3CCCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC2=NC(=CS2)C(=O)NCCNC(=O)CCC3CCCC3)C

InChI

InChI=1S/C23H31N3O3S/c1-16-11-17(2)13-19(12-16)29-14-22-26-20(15-30-22)23(28)25-10-9-24-21(27)8-7-18-5-3-4-6-18/h11-13,15,18H,3-10,14H2,1-2H3,(H,24,27)(H,25,28)