N-[3-cyano-4-(4-methoxyphenyl)-5-methyl-thiophen-2-yl]-2-(3-ethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[3-cyano-4-(4-methoxyphenyl)-5-methyl-thiophen-2-yl]-2-(3-ethoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[3-cyano-4-(4-methoxyphenyl)-5-methyl-2-thienyl]-2-(3-ethoxyphenyl)quinoline-4-carboxamide CAS Name: N-[3-cyano-4-(4-methoxyphenyl)-5-methyl-2-thiophenyl]-2-(3-ethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[3-cyano-4-(4-methoxyphenyl)-5-methylthiophen-2-yl]-2-(3-ethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[3-cyano-4-(4-methoxyphenyl)-5-methyl-2-thienyl]-2-m-phenetyl-cinchoninamide Formula: C31H25N3O3S MolecularWeight: 519.6135

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H25N3O3S/c1-4-37-23-9-7-8-21(16-23)28-17-25(24-10-5-6-11-27(24)33-28)30(35)34-31-26(18-32)29(19(2)38-31)20-12-14-22(36-3)15-13-20/h5-17H,4H2,1-3H3,(H,34,35)