2,5-diphenyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyrazole-3-carboxamide

Systemtic Name: 2,5-diphenyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyrazole-3-carboxamide Openeye Name: 2,5-diphenyl-N-[2-(2-thienylmethylsulfanyl)ethyl]pyrazole-3-carboxamide CAS Name: 2,5-diphenyl-N-[2-(thiophen-2-ylmethylthio)ethyl]-3-pyrazolecarboxamide IUPAC Name: 2,5-diphenyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyrazole-3-carboxamide Traditional Name: 2,5-diphenyl-N-[2-(2-thenylthio)ethyl]pyrazole-3-carboxamide Formula: C23H21N3OS2 MolecularWeight: 419.56234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=C2)C(=O)NCCSCC3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=C2)C(=O)NCCSCC3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3OS2/c27-23(24-13-15-28-17-20-12-7-14-29-20)22-16-21(18-8-3-1-4-9-18)25-26(22)19-10-5-2-6-11-19/h1-12,14,16H,13,15,17H2,(H,24,27)