N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[4-(2,4-dimethylphenyl)thiazol-2-yl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide CAS Name: N-[4-(2,4-dimethylphenyl)-2-thiazolyl]-2-(4-ethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[4-(2,4-dimethylphenyl)thiazol-2-yl]-2-p-phenetyl-cinchoninamide Formula: C29H25N3O2S MolecularWeight: 479.5927

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NC(=CS4)C5=C(C=C(C=C5)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NC(=CS4)C5=C(C=C(C=C5)C)C

InChI

InChI=1S/C29H25N3O2S/c1-4-34-21-12-10-20(11-13-21)26-16-24(23-7-5-6-8-25(23)30-26)28(33)32-29-31-27(17-35-29)22-14-9-18(2)15-19(22)3/h5-17H,4H2,1-3H3,(H,31,32,33)