N-[3-cyano-5-methyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide

Systemtic Name: N-[3-cyano-5-methyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide Openeye Name: N-[3-cyano-4-(4-isopropylphenyl)-5-methyl-2-thienyl]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide CAS Name: N-[3-cyano-5-methyl-4-(4-propan-2-ylphenyl)-2-thiophenyl]-2-(3,4-dimethylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[3-cyano-5-methyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide Traditional Name: N-(3-cyano-5-methyl-4-p-cumenyl-2-thienyl)-2-(3,4-dimethylphenyl)cinchoninamide Formula: C33H29N3OS MolecularWeight: 515.66786

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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=C(C(=C(S4)C)C5=CC=C(C=C5)C(C)C)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=C(S4)C)C5=CC=C(C=C5)C(C)C)C#N)C

InChI

InChI=1S/C33H29N3OS/c1-19(2)23-12-14-24(15-13-23)31-22(5)38-33(28(31)18-34)36-32(37)27-17-30(25-11-10-20(3)21(4)16-25)35-29-9-7-6-8-26(27)29/h6-17,19H,1-5H3,(H,36,37)