N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methoxyphenyl)-3,6-dimethyl-quinoline-4-carboxamide

Systemtic Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methoxyphenyl)-3,6-dimethyl-quinoline-4-carboxamide Openeye Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(4-methoxyphenyl)-3,6-dimethyl-quinoline-4-carboxamide CAS Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methoxyphenyl)-3,6-dimethyl-4-quinolinecarboxamide IUPAC Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methoxyphenyl)-3,6-dimethylquinoline-4-carboxamide Traditional Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(4-methoxyphenyl)-3,6-dimethyl-cinchoninamide Formula: C30H29N3O2S MolecularWeight: 495.63516

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=C4C=C(C=CC4=NC(=C3C)C5=CC=C(C=C5)OC)C

Isomeric SMILES

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=C4C=C(C=CC4=NC(=C3C)C5=CC=C(C=C5)OC)C

InChI

InChI=1S/C30H29N3O2S/c1-5-19-7-12-22-24(16-31)30(36-26(22)15-19)33-29(34)27-18(3)28(20-8-10-21(35-4)11-9-20)32-25-13-6-17(2)14-23(25)27/h6,8-11,13-14,19H,5,7,12,15H2,1-4H3,(H,33,34)