N-[(3,4-dimethoxyphenyl)methyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[(3,4-dimethoxyphenyl)methyl]-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[(3,4-dimethoxyphenyl)methyl]-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-3-(2-thienyl)-N-veratryl-pyrazole-4-carboxamide Formula: C24H23N3O3S MolecularWeight: 433.52272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23N3O3S/c1-29-20-11-10-18(13-21(20)30-2)14-25-24(28)19-16-27(15-17-7-4-3-5-8-17)26-23(19)22-9-6-12-31-22/h3-13,16H,14-15H2,1-2H3,(H,25,28)