3-cyano-2-methylsulfanyl-4-oxidanylidene-N-(3-phenylpropyl)quinolizine-1-carboxamide

Systemtic Name: 3-cyano-2-methylsulfanyl-4-oxidanylidene-N-(3-phenylpropyl)quinolizine-1-carboxamide Openeye Name: 3-cyano-2-methylsulfanyl-4-oxo-N-(3-phenylpropyl)quinolizine-1-carboxamide CAS Name: 3-cyano-2-(methylthio)-4-oxo-N-(3-phenylpropyl)-1-quinolizinecarboxamide IUPAC Name: 3-cyano-2-methylsulfanyl-4-oxo-N-(3-phenylpropyl)quinolizine-1-carboxamide Traditional Name: 3-cyano-4-keto-2-(methylthio)-N-(3-phenylpropyl)quinolizine-1-carboxamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=O)N2C=CC=CC2=C1C(=O)NCCCC3=CC=CC=C3)C#N

Isomeric SMILES

CSC1=C(C(=O)N2C=CC=CC2=C1C(=O)NCCCC3=CC=CC=C3)C#N

InChI

InChI=1S/C21H19N3O2S/c1-27-19-16(14-22)21(26)24-13-6-5-11-17(24)18(19)20(25)23-12-7-10-15-8-3-2-4-9-15/h2-6,8-9,11,13H,7,10,12H2,1H3,(H,23,25)