N-(2-pyridin-2-ylethyl)-2-[(2,3,5-trimethylphenoxy)methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(2-pyridin-2-ylethyl)-2-[(2,3,5-trimethylphenoxy)methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-[2-(2-pyridyl)ethyl]-2-[(2,3,5-trimethylphenoxy)methyl]thiazole-4-carboxamide CAS Name: N-[2-(2-pyridinyl)ethyl]-2-[(2,3,5-trimethylphenoxy)methyl]-4-thiazolecarboxamide IUPAC Name: N-(2-pyridin-2-ylethyl)-2-[(2,3,5-trimethylphenoxy)methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[2-(2-pyridyl)ethyl]-2-[(2,3,5-trimethylphenoxy)methyl]thiazole-4-carboxamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCC2=NC(=CS2)C(=O)NCCC3=CC=CC=N3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCC2=NC(=CS2)C(=O)NCCC3=CC=CC=N3)C)C

InChI

InChI=1S/C21H23N3O2S/c1-14-10-15(2)16(3)19(11-14)26-12-20-24-18(13-27-20)21(25)23-9-7-17-6-4-5-8-22-17/h4-6,8,10-11,13H,7,9,12H2,1-3H3,(H,23,25)