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

Systemtic Name: N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide Openeye Name: N-[4-(4-tert-butylphenyl)thiazol-2-yl]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide CAS Name: N-[4-(4-tert-butylphenyl)-2-thiazolyl]-2-(3,4-dimethylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide Traditional Name: N-[4-(4-tert-butylphenyl)thiazol-2-yl]-2-(3,4-dimethylphenyl)cinchoninamide Formula: C31H29N3OS MolecularWeight: 491.64646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NC(=CS4)C5=CC=C(C=C5)C(C)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NC(=CS4)C5=CC=C(C=C5)C(C)(C)C)C

InChI

InChI=1S/C31H29N3OS/c1-19-10-11-22(16-20(19)2)27-17-25(24-8-6-7-9-26(24)32-27)29(35)34-30-33-28(18-36-30)21-12-14-23(15-13-21)31(3,4)5/h6-18H,1-5H3,(H,33,34,35)