N-[(2R)-1-[(2,6-dimethylphenyl)amino]-2-methyl-1-oxidanylidene-butan-2-yl]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[(2R)-1-[(2,6-dimethylphenyl)amino]-2-methyl-1-oxidanylidene-butan-2-yl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[(1R)-1-[(2,6-dimethylphenyl)carbamoyl]-1-methyl-propyl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[(2R)-1-(2,6-dimethylanilino)-2-methyl-1-oxobutan-2-yl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[(2R)-1-(2,6-dimethylanilino)-2-methyl-1-oxobutan-2-yl]-2-phenylquinoline-4-carboxamide Traditional Name: N-[(1R)-1-[(2,6-dimethylphenyl)carbamoyl]-1-methyl-propyl]-2-phenyl-cinchoninamide Formula: C29H29N3O2 MolecularWeight: 451.55946

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)NC1=C(C=CC=C1C)C)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC[C@](C)(C(=O)NC1=C(C=CC=C1C)C)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C29H29N3O2/c1-5-29(4,28(34)31-26-19(2)12-11-13-20(26)3)32-27(33)23-18-25(21-14-7-6-8-15-21)30-24-17-10-9-16-22(23)24/h6-18H,5H2,1-4H3,(H,31,34)(H,32,33)/t29-/m1/s1