2-[(4-chloranylphenoxy)methyl]-N-(2-phenylpyrimidin-5-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(4-chloranylphenoxy)methyl]-N-(2-phenylpyrimidin-5-yl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[(4-chlorophenoxy)methyl]-N-(2-phenylpyrimidin-5-yl)thiazole-4-carboxamide CAS Name: 2-[(4-chlorophenoxy)methyl]-N-(2-phenyl-5-pyrimidinyl)-4-thiazolecarboxamide IUPAC Name: 2-[(4-chlorophenoxy)methyl]-N-(2-phenylpyrimidin-5-yl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[(4-chlorophenoxy)methyl]-N-(2-phenylpyrimidin-5-yl)thiazole-4-carboxamide Formula: C21H15ClN4O2S MolecularWeight: 422.8874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC=C(C=N2)NC(=O)C3=CSC(=N3)COC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC=C(C=N2)NC(=O)C3=CSC(=N3)COC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H15ClN4O2S/c22-15-6-8-17(9-7-15)28-12-19-26-18(13-29-19)21(27)25-16-10-23-20(24-11-16)14-4-2-1-3-5-14/h1-11,13H,12H2,(H,25,27)