1-(2,3,3a,4,5,6,7,7a-octahydroindol-1-ylcarbonyl)-2-methylsulfanyl-4-oxidanylidene-quinolizine-3-carbonitrile

Systemtic Name: 1-(2,3,3a,4,5,6,7,7a-octahydroindol-1-ylcarbonyl)-2-methylsulfanyl-4-oxidanylidene-quinolizine-3-carbonitrile Openeye Name: 1-(2,3,3a,4,5,6,7,7a-octahydroindole-1-carbonyl)-2-methylsulfanyl-4-oxo-quinolizine-3-carbonitrile CAS Name: 1-[2,3,3a,4,5,6,7,7a-octahydroindol-1-yl(oxo)methyl]-2-(methylthio)-4-oxo-3-quinolizinecarbonitrile IUPAC Name: 1-(2,3,3a,4,5,6,7,7a-octahydroindole-1-carbonyl)-2-methylsulfanyl-4-oxoquinolizine-3-carbonitrile Traditional Name: 1-(2,3,3a,4,5,6,7,7a-octahydroindole-1-carbonyl)-4-keto-2-(methylthio)quinolizine-3-carbonitrile Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=O)N2C=CC=CC2=C1C(=O)N3CCC4C3CCCC4)C#N

Isomeric SMILES

CSC1=C(C(=O)N2C=CC=CC2=C1C(=O)N3CCC4C3CCCC4)C#N

InChI

InChI=1S/C20H21N3O2S/c1-26-18-14(12-21)19(24)22-10-5-4-8-16(22)17(18)20(25)23-11-9-13-6-2-3-7-15(13)23/h4-5,8,10,13,15H,2-3,6-7,9,11H2,1H3