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

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-[3-(pyrazol-1-ylmethyl)phenyl]ethanamide Openeye Name: 2-indan-5-ylsulfanyl-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide CAS Name: 2-(2,3-dihydro-1H-inden-5-ylthio)-N-[3-(1-pyrazolylmethyl)phenyl]acetamide IUPAC Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide Traditional Name: 2-(indan-5-ylthio)-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)SCC(=O)NC3=CC=CC(=C3)CN4C=CC=N4

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)SCC(=O)NC3=CC=CC(=C3)CN4C=CC=N4

InChI

InChI=1S/C21H21N3OS/c25-21(15-26-20-9-8-17-5-2-6-18(17)13-20)23-19-7-1-4-16(12-19)14-24-11-3-10-22-24/h1,3-4,7-13H,2,5-6,14-15H2,(H,23,25)