(1,3-diphenylpyrazol-4-yl)methyl 3-methylthiophene-2-carboxylate

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl 3-methylthiophene-2-carboxylate Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl 3-methylthiophene-2-carboxylate CAS Name: 3-methyl-2-thiophenecarboxylic acid (1,3-diphenyl-4-pyrazolyl)methyl ester IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl 3-methylthiophene-2-carboxylate Traditional Name: 3-methylthiophene-2-carboxylic acid (1,3-diphenylpyrazol-4-yl)methyl ester Formula: C22H18N2O2S MolecularWeight: 374.45552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)OCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC=C1)C(=O)OCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2O2S/c1-16-12-13-27-21(16)22(25)26-15-18-14-24(19-10-6-3-7-11-19)23-20(18)17-8-4-2-5-9-17/h2-14H,15H2,1H3