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

Systemtic Name: 7-chloranyl-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-ethoxyphenyl)-8-methyl-quinoline-4-carboxamide Openeye Name: 7-chloro-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(4-ethoxyphenyl)-8-methyl-quinoline-4-carboxamide CAS Name: 7-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-ethoxyphenyl)-8-methyl-4-quinolinecarboxamide IUPAC Name: 7-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-ethoxyphenyl)-8-methylquinoline-4-carboxamide Traditional Name: 7-chloro-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-8-methyl-2-p-phenetyl-cinchoninamide Formula: C28H24ClN3O2S MolecularWeight: 502.02706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3C)Cl)C(=C2)C(=O)NC4=C(C5=C(S4)CCCC5)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3C)Cl)C(=C2)C(=O)NC4=C(C5=C(S4)CCCC5)C#N

InChI

InChI=1S/C28H24ClN3O2S/c1-3-34-18-10-8-17(9-11-18)24-14-21(20-12-13-23(29)16(2)26(20)31-24)27(33)32-28-22(15-30)19-6-4-5-7-25(19)35-28/h8-14H,3-7H2,1-2H3,(H,32,33)