1-methyl-3-[(3R)-3-[4-(2-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]carbonyl-quinolin-4-one

Systemtic Name: 1-methyl-3-[(3R)-3-[4-(2-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]carbonyl-quinolin-4-one Openeye Name: 1-methyl-3-[(3R)-3-[4-(o-tolyl)-1H-pyrazol-5-yl]piperidine-1-carbonyl]quinolin-4-one CAS Name: 1-methyl-3-[[(3R)-3-[4-(2-methylphenyl)-1H-pyrazol-5-yl]-1-piperidinyl]-oxomethyl]-4-quinolinone IUPAC Name: 1-methyl-3-[(3R)-3-[4-(2-methylphenyl)-1H-pyrazol-5-yl]piperidine-1-carbonyl]quinolin-4-one Traditional Name: 1-methyl-3-[(3R)-3-[4-(o-tolyl)-1H-pyrazol-5-yl]piperidine-1-carbonyl]-4-quinolone Formula: C26H26N4O2 MolecularWeight: 426.51024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(NN=C2)C3CCCN(C3)C(=O)C4=CN(C5=CC=CC=C5C4=O)C

Isomeric SMILES

CC1=CC=CC=C1C2=C(NN=C2)[C@@H]3CCCN(C3)C(=O)C4=CN(C5=CC=CC=C5C4=O)C

InChI

InChI=1S/C26H26N4O2/c1-17-8-3-4-10-19(17)21-14-27-28-24(21)18-9-7-13-30(15-18)26(32)22-16-29(2)23-12-6-5-11-20(23)25(22)31/h3-6,8,10-12,14,16,18H,7,9,13,15H2,1-2H3,(H,27,28)/t18-/m1/s1