5-chloranyl-3-methyl-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-3-methyl-N-[4-(p-tolyl)thiazol-2-yl]pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-N-[4-(4-methylphenyl)-2-thiazolyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-3-methyl-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-3-methyl-N-[4-(p-tolyl)thiazol-2-yl]pyrazole-4-carboxamide Formula: C22H19ClN4OS MolecularWeight: 422.93046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(N(N=C3C)CC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(N(N=C3C)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C22H19ClN4OS/c1-14-8-10-17(11-9-14)18-13-29-22(24-18)25-21(28)19-15(2)26-27(20(19)23)12-16-6-4-3-5-7-16/h3-11,13H,12H2,1-2H3,(H,24,25,28)