4-(3,4-dimethoxyphenyl)-1-phenyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyrazole-3-carboxamide

Systemtic Name: 4-(3,4-dimethoxyphenyl)-1-phenyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyrazole-3-carboxamide Openeye Name: 4-(3,4-dimethoxyphenyl)-1-phenyl-N-[2-(2-thienylmethylsulfanyl)ethyl]pyrazole-3-carboxamide CAS Name: 4-(3,4-dimethoxyphenyl)-1-phenyl-N-[2-(thiophen-2-ylmethylthio)ethyl]-3-pyrazolecarboxamide IUPAC Name: 4-(3,4-dimethoxyphenyl)-1-phenyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyrazole-3-carboxamide Traditional Name: 4-(3,4-dimethoxyphenyl)-1-phenyl-N-[2-(2-thenylthio)ethyl]pyrazole-3-carboxamide Formula: C25H25N3O3S2 MolecularWeight: 479.6143

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CN(N=C2C(=O)NCCSCC3=CC=CS3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CN(N=C2C(=O)NCCSCC3=CC=CS3)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H25N3O3S2/c1-30-22-11-10-18(15-23(22)31-2)21-16-28(19-7-4-3-5-8-19)27-24(21)25(29)26-12-14-32-17-20-9-6-13-33-20/h3-11,13,15-16H,12,14,17H2,1-2H3,(H,26,29)