2-methylsulfanyl-4-oxidanylidene-1-(4-phenylbutanoyl)quinolizine-3-carbonitrile

Systemtic Name: 2-methylsulfanyl-4-oxidanylidene-1-(4-phenylbutanoyl)quinolizine-3-carbonitrile Openeye Name: 2-methylsulfanyl-4-oxo-1-(4-phenylbutanoyl)quinolizine-3-carbonitrile CAS Name: 2-(methylthio)-4-oxo-1-(1-oxo-4-phenylbutyl)-3-quinolizinecarbonitrile IUPAC Name: 2-methylsulfanyl-4-oxo-1-(4-phenylbutanoyl)quinolizine-3-carbonitrile Traditional Name: 4-keto-2-(methylthio)-1-(4-phenylbutanoyl)quinolizine-3-carbonitrile Formula: C21H18N2O2S MolecularWeight: 362.44482

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=O)N2C=CC=CC2=C1C(=O)CCCC3=CC=CC=C3)C#N

Isomeric SMILES

CSC1=C(C(=O)N2C=CC=CC2=C1C(=O)CCCC3=CC=CC=C3)C#N

InChI

InChI=1S/C21H18N2O2S/c1-26-20-16(14-22)21(25)23-13-6-5-11-17(23)19(20)18(24)12-7-10-15-8-3-2-4-9-15/h2-6,8-9,11,13H,7,10,12H2,1H3