N-(4-methyl-2-oxidanyl-phenyl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-(4-methyl-2-oxidanyl-phenyl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(2-hydroxy-4-methyl-phenyl)-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-(2-hydroxy-4-methylphenyl)-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(2-hydroxy-4-methylphenyl)-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(2-hydroxy-4-methyl-phenyl)-3-(2-thienyl)pyrazole-4-carboxamide Formula: C22H19N3O2S MolecularWeight: 389.47016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)O

InChI

InChI=1S/C22H19N3O2S/c1-15-9-10-18(19(26)12-15)23-22(27)17-14-25(13-16-6-3-2-4-7-16)24-21(17)20-8-5-11-28-20/h2-12,14,26H,13H2,1H3,(H,23,27)