N-(3-chloranyl-4-methyl-phenyl)-2-[5-methyl-1-(4-propan-2-ylphenyl)pyrazol-4-yl]quinoline-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-[5-methyl-1-(4-propan-2-ylphenyl)pyrazol-4-yl]quinoline-4-carboxamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-[1-(4-isopropylphenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[5-methyl-1-(4-propan-2-ylphenyl)-4-pyrazolyl]-4-quinolinecarboxamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-[5-methyl-1-(4-propan-2-ylphenyl)pyrazol-4-yl]quinoline-4-carboxamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-(5-methyl-1-p-cumenyl-pyrazol-4-yl)cinchoninamide Formula: C30H27ClN4O MolecularWeight: 495.01458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(N(N=C4)C5=CC=C(C=C5)C(C)C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(N(N=C4)C5=CC=C(C=C5)C(C)C)C)Cl

InChI

InChI=1S/C30H27ClN4O/c1-18(2)21-10-13-23(14-11-21)35-20(4)26(17-32-35)29-16-25(24-7-5-6-8-28(24)34-29)30(36)33-22-12-9-19(3)27(31)15-22/h5-18H,1-4H3,(H,33,36)