2-methylsulfanyl-4-oxidanylidene-1-(5-phenylpentanoyl)quinolizine-3-carbonitrile

Systemtic Name: 2-methylsulfanyl-4-oxidanylidene-1-(5-phenylpentanoyl)quinolizine-3-carbonitrile Openeye Name: 2-methylsulfanyl-4-oxo-1-(5-phenylpentanoyl)quinolizine-3-carbonitrile CAS Name: 2-(methylthio)-4-oxo-1-(1-oxo-5-phenylpentyl)-3-quinolizinecarbonitrile IUPAC Name: 2-methylsulfanyl-4-oxo-1-(5-phenylpentanoyl)quinolizine-3-carbonitrile Traditional Name: 4-keto-2-(methylthio)-1-(5-phenylpentanoyl)quinolizine-3-carbonitrile Formula: C22H20N2O2S MolecularWeight: 376.4714

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=O)N2C=CC=CC2=C1C(=O)CCCCC3=CC=CC=C3)C#N

Isomeric SMILES

CSC1=C(C(=O)N2C=CC=CC2=C1C(=O)CCCCC3=CC=CC=C3)C#N

InChI

InChI=1S/C22H20N2O2S/c1-27-21-17(15-23)22(26)24-14-8-7-12-18(24)20(21)19(25)13-6-5-11-16-9-3-2-4-10-16/h2-4,7-10,12,14H,5-6,11,13H2,1H3