4-methoxy-N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]-1-phenyl-pyrazole-3-carboxamide

Systemtic Name: 4-methoxy-N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]-1-phenyl-pyrazole-3-carboxamide Openeye Name: 4-methoxy-N-[4-(4-methylsulfanylphenyl)thiazol-2-yl]-1-phenyl-pyrazole-3-carboxamide CAS Name: 4-methoxy-N-[4-[4-(methylthio)phenyl]-2-thiazolyl]-1-phenyl-3-pyrazolecarboxamide IUPAC Name: 4-methoxy-N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]-1-phenylpyrazole-3-carboxamide Traditional Name: 4-methoxy-N-[4-[4-(methylthio)phenyl]thiazol-2-yl]-1-phenyl-pyrazole-3-carboxamide Formula: C21H18N4O2S2 MolecularWeight: 422.52322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)SC)C4=CC=CC=C4

Isomeric SMILES

COC1=CN(N=C1C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)SC)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O2S2/c1-27-18-12-25(15-6-4-3-5-7-15)24-19(18)20(26)23-21-22-17(13-29-21)14-8-10-16(28-2)11-9-14/h3-13H,1-2H3,(H,22,23,26)