1-(phenylmethyl)-3-thiophen-2-yl-N-[(2,4,5-trimethoxyphenyl)methyl]pyrazole-4-carboxamide

Systemtic Name: 1-(phenylmethyl)-3-thiophen-2-yl-N-[(2,4,5-trimethoxyphenyl)methyl]pyrazole-4-carboxamide Openeye Name: 1-benzyl-3-(2-thienyl)-N-[(2,4,5-trimethoxyphenyl)methyl]pyrazole-4-carboxamide CAS Name: 1-(phenylmethyl)-3-thiophen-2-yl-N-[(2,4,5-trimethoxyphenyl)methyl]-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-3-thiophen-2-yl-N-[(2,4,5-trimethoxyphenyl)methyl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-3-(2-thienyl)-N-(2,4,5-trimethoxybenzyl)pyrazole-4-carboxamide Formula: C25H25N3O4S MolecularWeight: 463.5487

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)OC)OC

InChI

InChI=1S/C25H25N3O4S/c1-30-20-13-22(32-3)21(31-2)12-18(20)14-26-25(29)19-16-28(15-17-8-5-4-6-9-17)27-24(19)23-10-7-11-33-23/h4-13,16H,14-15H2,1-3H3,(H,26,29)