N-(3,5-dimethoxyphenyl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(3,5-dimethoxyphenyl)-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-(3,5-dimethoxyphenyl)-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(3,5-dimethoxyphenyl)-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(3,5-dimethoxyphenyl)-3-(2-thienyl)pyrazole-4-carboxamide Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)OC

InChI

InChI=1S/C23H21N3O3S/c1-28-18-11-17(12-19(13-18)29-2)24-23(27)20-15-26(14-16-7-4-3-5-8-16)25-22(20)21-9-6-10-30-21/h3-13,15H,14H2,1-2H3,(H,24,27)