N-(5-chloranyl-2-cyano-phenyl)-2-[(3-cyano-5-oxidanylidene-4-pyridin-3-yl-4,6,7,8-tetrahydro-1H-quinolin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(5-chloranyl-2-cyano-phenyl)-2-[(3-cyano-5-oxidanylidene-4-pyridin-3-yl-4,6,7,8-tetrahydro-1H-quinolin-2-yl)sulfanyl]ethanamide Openeye Name: N-(5-chloro-2-cyano-phenyl)-2-[[3-cyano-5-oxo-4-(3-pyridyl)-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]acetamide CAS Name: N-(5-chloro-2-cyanophenyl)-2-[[3-cyano-5-oxo-4-(3-pyridinyl)-4,6,7,8-tetrahydro-1H-quinolin-2-yl]thio]acetamide IUPAC Name: N-(5-chloro-2-cyanophenyl)-2-[(3-cyano-5-oxo-4-pyridin-3-yl-4,6,7,8-tetrahydro-1H-quinolin-2-yl)sulfanyl]acetamide Traditional Name: N-(5-chloro-2-cyano-phenyl)-2-[[3-cyano-5-keto-4-(3-pyridyl)-4,6,7,8-tetrahydro-1H-quinolin-2-yl]thio]acetamide Formula: C24H18ClN5O2S MolecularWeight: 475.95002

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=C(N2)SCC(=O)NC3=C(C=CC(=C3)Cl)C#N)C#N)C4=CN=CC=C4)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C(=C(N2)SCC(=O)NC3=C(C=CC(=C3)Cl)C#N)C#N)C4=CN=CC=C4)C(=O)C1

InChI

InChI=1S/C24H18ClN5O2S/c25-16-7-6-14(10-26)19(9-16)29-21(32)13-33-24-17(11-27)22(15-3-2-8-28-12-15)23-18(30-24)4-1-5-20(23)31/h2-3,6-9,12,22,30H,1,4-5,13H2,(H,29,32)