2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-indan-5-ylsulfanyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-(2,3-dihydro-1H-inden-5-ylthio)-N-[[2-(1-pyrazolylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-(indan-5-ylthio)-N-[2-(pyrazol-1-ylmethyl)benzyl]acetamide Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)SCC(=O)NCC3=CC=CC=C3CN4C=CC=N4

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)SCC(=O)NCC3=CC=CC=C3CN4C=CC=N4

InChI

InChI=1S/C22H23N3OS/c26-22(16-27-21-10-9-17-7-3-8-18(17)13-21)23-14-19-5-1-2-6-20(19)15-25-12-4-11-24-25/h1-2,4-6,9-13H,3,7-8,14-16H2,(H,23,26)