(1-methylpyrazol-4-yl)methyl 1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxylate

Systemtic Name: (1-methylpyrazol-4-yl)methyl 1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxylate Openeye Name: (1-methylpyrazol-4-yl)methyl 1-benzyl-3-(2-thienyl)pyrazole-4-carboxylate CAS Name: 1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxylic acid (1-methyl-4-pyrazolyl)methyl ester IUPAC Name: (1-methylpyrazol-4-yl)methyl 1-benzyl-3-thiophen-2-ylpyrazole-4-carboxylate Traditional Name: 1-benzyl-3-(2-thienyl)pyrazole-4-carboxylic acid (1-methylpyrazol-4-yl)methyl ester Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)COC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

CN1C=C(C=N1)COC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C20H18N4O2S/c1-23-11-16(10-21-23)14-26-20(25)17-13-24(12-15-6-3-2-4-7-15)22-19(17)18-8-5-9-27-18/h2-11,13H,12,14H2,1H3