N-(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(5-ethylthiophen-2-yl)-6,8-dimethyl-quinoline-4-carboxamide

Systemtic Name: N-(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(5-ethylthiophen-2-yl)-6,8-dimethyl-quinoline-4-carboxamide Openeye Name: N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(5-ethyl-2-thienyl)-6,8-dimethyl-quinoline-4-carboxamide CAS Name: N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(5-ethyl-2-thiophenyl)-6,8-dimethyl-4-quinolinecarboxamide IUPAC Name: N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(5-ethylthiophen-2-yl)-6,8-dimethylquinoline-4-carboxamide Traditional Name: N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(5-ethyl-2-thienyl)-6,8-dimethyl-cinchoninamide Formula: C27H27N3O2S2 MolecularWeight: 489.65218

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)NC4=C(C5=C(S4)CCCC5)C(=O)N)C)C

Isomeric SMILES

CCC1=CC=C(S1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)NC4=C(C5=C(S4)CCCC5)C(=O)N)C)C

InChI

InChI=1S/C27H27N3O2S2/c1-4-16-9-10-22(33-16)20-13-19(18-12-14(2)11-15(3)24(18)29-20)26(32)30-27-23(25(28)31)17-7-5-6-8-21(17)34-27/h9-13H,4-8H2,1-3H3,(H2,28,31)(H,30,32)