N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-8-fluoranyl-1-methyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-8-fluoranyl-1-methyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-8-fluoro-1-methyl-4-oxo-quinoline-3-carboxamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-8-fluoro-1-methyl-4-oxo-3-quinolinecarboxamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-8-fluoro-1-methyl-4-oxoquinoline-3-carboxamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-8-fluoro-4-keto-1-methyl-quinoline-3-carboxamide Formula: C20H16FN3O2S MolecularWeight: 381.423343

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=C1C(=CC=C2)F)C(=O)NC3=C(C4=C(S3)CCCC4)C#N

Isomeric SMILES

CN1C=C(C(=O)C2=C1C(=CC=C2)F)C(=O)NC3=C(C4=C(S3)CCCC4)C#N

InChI

InChI=1S/C20H16FN3O2S/c1-24-10-14(18(25)12-6-4-7-15(21)17(12)24)19(26)23-20-13(9-22)11-5-2-3-8-16(11)27-20/h4,6-7,10H,2-3,5,8H2,1H3,(H,23,26)