2-methylsulfanyl-6-[[8-(3-phenylprop-2-ynoyl)-3,8-diazaspiro[4.5]decan-3-yl]methyl]pyridine-3-carbonitrile

Systemtic Name: 2-methylsulfanyl-6-[[8-(3-phenylprop-2-ynoyl)-3,8-diazaspiro[4.5]decan-3-yl]methyl]pyridine-3-carbonitrile Openeye Name: 2-methylsulfanyl-6-[[8-(3-phenylprop-2-ynoyl)-3,8-diazaspiro[4.5]decan-3-yl]methyl]pyridine-3-carbonitrile CAS Name: 2-(methylthio)-6-[[8-(1-oxo-3-phenylprop-2-ynyl)-3,8-diazaspiro[4.5]decan-3-yl]methyl]-3-pyridinecarbonitrile IUPAC Name: 2-methylsulfanyl-6-[[8-(3-phenylprop-2-ynoyl)-3,8-diazaspiro[4.5]decan-3-yl]methyl]pyridine-3-carbonitrile Traditional Name: 2-(methylthio)-6-[[8-(3-phenylpropioloyl)-3,8-diazaspiro[4.5]decan-3-yl]methyl]nicotinonitrile Formula: C25H26N4OS MolecularWeight: 430.56514

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC(=N1)CN2CCC3(C2)CCN(CC3)C(=O)C#CC4=CC=CC=C4)C#N

Isomeric SMILES

CSC1=C(C=CC(=N1)CN2CCC3(C2)CCN(CC3)C(=O)C#CC4=CC=CC=C4)C#N

InChI

InChI=1S/C25H26N4OS/c1-31-24-21(17-26)8-9-22(27-24)18-28-14-11-25(19-28)12-15-29(16-13-25)23(30)10-7-20-5-3-2-4-6-20/h2-6,8-9H,11-16,18-19H2,1H3