N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)piperidin-3-yl]methyl]-2-(5-phenylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)piperidin-3-yl]methyl]-2-(5-phenylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[[1-(indan-5-ylmethyl)-3-piperidyl]methyl]-2-(5-phenylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)-3-piperidinyl]methyl]-2-[(5-phenyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)piperidin-3-yl]methyl]-2-(5-phenylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[[1-(indan-5-ylmethyl)-3-piperidyl]methyl]-2-[(5-phenylpyrimidin-2-yl)thio]acetamide Formula: C28H32N4OS MolecularWeight: 472.64488

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC3=C(CCC3)C=C2)CNC(=O)CSC4=NC=C(C=N4)C5=CC=CC=C5

Isomeric SMILES

C1CC(CN(C1)CC2=CC3=C(CCC3)C=C2)CNC(=O)CSC4=NC=C(C=N4)C5=CC=CC=C5

InChI

InChI=1S/C28H32N4OS/c33-27(20-34-28-30-16-26(17-31-28)23-7-2-1-3-8-23)29-15-22-6-5-13-32(19-22)18-21-11-12-24-9-4-10-25(24)14-21/h1-3,7-8,11-12,14,16-17,22H,4-6,9-10,13,15,18-20H2,(H,29,33)