5,8-dimethyl-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-quinoline-3-carbonitrile

Systemtic Name: 5,8-dimethyl-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-quinoline-3-carbonitrile Openeye Name: 5,8-dimethyl-2-(2-morpholino-2-oxo-ethyl)sulfanyl-quinoline-3-carbonitrile CAS Name: 5,8-dimethyl-2-[[2-(4-morpholinyl)-2-oxoethyl]thio]-3-quinolinecarbonitrile IUPAC Name: 5,8-dimethyl-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylquinoline-3-carbonitrile Traditional Name: 2-[(2-keto-2-morpholino-ethyl)thio]-5,8-dimethyl-quinoline-3-carbonitrile Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=NC2=C(C=C1)C)SCC(=O)N3CCOCC3)C#N

Isomeric SMILES

CC1=C2C=C(C(=NC2=C(C=C1)C)SCC(=O)N3CCOCC3)C#N

InChI

InChI=1S/C18H19N3O2S/c1-12-3-4-13(2)17-15(12)9-14(10-19)18(20-17)24-11-16(22)21-5-7-23-8-6-21/h3-4,9H,5-8,11H2,1-2H3