2-[2-(4-hydroxyphenyl)ethynyl]-4-methyl-N-(2-phenoxyethyl)-1,3-thiazole-5-carboxamide

Systemtic Name: 2-[2-(4-hydroxyphenyl)ethynyl]-4-methyl-N-(2-phenoxyethyl)-1,3-thiazole-5-carboxamide Openeye Name: 2-[2-(4-hydroxyphenyl)ethynyl]-4-methyl-N-(2-phenoxyethyl)thiazole-5-carboxamide CAS Name: 2-[2-(4-hydroxyphenyl)ethynyl]-4-methyl-N-(2-phenoxyethyl)-5-thiazolecarboxamide IUPAC Name: 2-[2-(4-hydroxyphenyl)ethynyl]-4-methyl-N-(2-phenoxyethyl)-1,3-thiazole-5-carboxamide Traditional Name: 2-[2-(4-hydroxyphenyl)ethynyl]-4-methyl-N-(2-phenoxyethyl)thiazole-5-carboxamide Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C#CC2=CC=C(C=C2)O)C(=O)NCCOC3=CC=CC=C3

Isomeric SMILES

CC1=C(SC(=N1)C#CC2=CC=C(C=C2)O)C(=O)NCCOC3=CC=CC=C3

InChI

InChI=1S/C21H18N2O3S/c1-15-20(21(25)22-13-14-26-18-5-3-2-4-6-18)27-19(23-15)12-9-16-7-10-17(24)11-8-16/h2-8,10-11,24H,13-14H2,1H3,(H,22,25)