3-[3-(1-benzothiophen-3-yl)phenyl]-7-chloranyl-2-oxidanyl-4-oxidanylidene-1H-quinoline-6-carbonitrile

Systemtic Name: 3-[3-(1-benzothiophen-3-yl)phenyl]-7-chloranyl-2-oxidanyl-4-oxidanylidene-1H-quinoline-6-carbonitrile Openeye Name: 3-[3-(benzothiophen-3-yl)phenyl]-7-chloro-2-hydroxy-4-oxo-1H-quinoline-6-carbonitrile CAS Name: 3-[3-(1-benzothiophen-3-yl)phenyl]-7-chloro-2-hydroxy-4-oxo-1H-quinoline-6-carbonitrile IUPAC Name: 3-[3-(1-benzothiophen-3-yl)phenyl]-7-chloro-2-hydroxy-4-oxo-1H-quinoline-6-carbonitrile Traditional Name: 3-[3-(benzothiophen-3-yl)phenyl]-7-chloro-2-hydroxy-4-keto-1H-quinoline-6-carbonitrile Formula: C24H13ClN2O2S MolecularWeight: 428.89022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CS2)C3=CC(=CC=C3)C4=C(NC5=C(C4=O)C=C(C(=C5)Cl)C#N)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CS2)C3=CC(=CC=C3)C4=C(NC5=C(C4=O)C=C(C(=C5)Cl)C#N)O

InChI

InChI=1S/C24H13ClN2O2S/c25-19-10-20-17(9-15(19)11-26)23(28)22(24(29)27-20)14-5-3-4-13(8-14)18-12-30-21-7-2-1-6-16(18)21/h1-10,12H,(H2,27,28,29)