4-(2-diethylaminoethylamino)-2-methylsulfanyl-quinoline-3-carbonitrile

Systemtic Name: 4-(2-diethylaminoethylamino)-2-methylsulfanyl-quinoline-3-carbonitrile Openeye Name: 4-(2-diethylaminoethylamino)-2-methylsulfanyl-quinoline-3-carbonitrile CAS Name: 4-(2-diethylaminoethylamino)-2-(methylthio)-3-quinolinecarbonitrile IUPAC Name: 4-(2-diethylaminoethylamino)-2-methylsulfanylquinoline-3-carbonitrile Traditional Name: 4-(2-diethylaminoethylamino)-2-(methylthio)quinoline-3-carbonitrile Formula: C17H22N4S MolecularWeight: 314.44838

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=C(C(=NC2=CC=CC=C21)SC)C#N

Isomeric SMILES

CCN(CC)CCNC1=C(C(=NC2=CC=CC=C21)SC)C#N

InChI

InChI=1S/C17H22N4S/c1-4-21(5-2)11-10-19-16-13-8-6-7-9-15(13)20-17(22-3)14(16)12-18/h6-9H,4-5,10-11H2,1-3H3,(H,19,20)