N-(4,5-dimethyl-1,3-thiazol-2-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(4,5-dimethylthiazol-2-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(4,5-dimethyl-2-thiazolyl)-1-[(4-phenylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(4,5-dimethylthiazol-2-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C22H20N4O2S/c1-15-16(2)29-22(23-15)24-21(27)20-12-13-26(25-20)14-28-19-10-8-18(9-11-19)17-6-4-3-5-7-17/h3-13H,14H2,1-2H3,(H,23,24,27)