ethyl 4-[2-[[(Z)-2-azanyl-2-cyano-1-methylsulfanyl-ethenyl]amino]ethylamino]-2-oxidanylidene-1-phenyl-quinoline-3-carboxylate

Systemtic Name: ethyl 4-[2-[[(Z)-2-azanyl-2-cyano-1-methylsulfanyl-ethenyl]amino]ethylamino]-2-oxidanylidene-1-phenyl-quinoline-3-carboxylate Openeye Name: ethyl 4-[2-[[(Z)-2-amino-2-cyano-1-methylsulfanyl-vinyl]amino]ethylamino]-2-oxo-1-phenyl-quinoline-3-carboxylate CAS Name: 4-[2-[[(Z)-2-amino-2-cyano-1-(methylthio)ethenyl]amino]ethylamino]-2-oxo-1-phenyl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[[(Z)-2-amino-2-cyano-1-methylsulfanylethenyl]amino]ethylamino]-2-oxo-1-phenylquinoline-3-carboxylate Traditional Name: 4-[2-[[(Z)-2-amino-2-cyano-1-(methylthio)vinyl]amino]ethylamino]-2-keto-1-phenyl-quinoline-3-carboxylic acid ethyl ester Formula: C24H25N5O3S MolecularWeight: 463.552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N(C1=O)C3=CC=CC=C3)NCCNC(=C(C#N)N)SC

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N(C1=O)C3=CC=CC=C3)NCCN/C(=C(\C#N)/N)/SC

InChI

InChI=1S/C24H25N5O3S/c1-3-32-24(31)20-21(27-13-14-28-22(33-2)18(26)15-25)17-11-7-8-12-19(17)29(23(20)30)16-9-5-4-6-10-16/h4-12,27-28H,3,13-14,26H2,1-2H3/b22-18-