2-ethanimidoyl-3-oxidanylidene-4-(4,6,8-trimethylquinolin-2-yl)sulfanyl-butanenitrile

Systemtic Name: 2-ethanimidoyl-3-oxidanylidene-4-(4,6,8-trimethylquinolin-2-yl)sulfanyl-butanenitrile Openeye Name: 2-ethanimidoyl-3-oxo-4-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]butanenitrile CAS Name: 2-(1-iminoethyl)-3-oxo-4-[(4,6,8-trimethyl-2-quinolinyl)thio]butanenitrile IUPAC Name: 2-ethanimidoyl-3-oxo-4-(4,6,8-trimethylquinolin-2-yl)sulfanylbutanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-[(4,6,8-trimethyl-2-quinolyl)thio]butyronitrile Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC(=O)C(C#N)C(=N)C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC(=O)C(C#N)C(=N)C)C)C

InChI

InChI=1S/C18H19N3OS/c1-10-5-12(3)18-14(6-10)11(2)7-17(21-18)23-9-16(22)15(8-19)13(4)20/h5-7,15,20H,9H2,1-4H3