6-[(3S,4R)-3-(5-chloranylpyridin-2-yl)-4-[(3R,5S)-4-(4-methoxyphenyl)-3,5-dimethyl-4-oxidanyl-piperidin-1-yl]carbonyl-pyrrolidin-1-yl]-2-methyl-pyridazin-3-one

Systemtic Name: 6-[(3S,4R)-3-(5-chloranylpyridin-2-yl)-4-[(3R,5S)-4-(4-methoxyphenyl)-3,5-dimethyl-4-oxidanyl-piperidin-1-yl]carbonyl-pyrrolidin-1-yl]-2-methyl-pyridazin-3-one Openeye Name: 6-[(3S,4R)-3-(5-chloro-2-pyridyl)-4-[(3R,5S)-4-hydroxy-4-(4-methoxyphenyl)-3,5-dimethyl-piperidine-1-carbonyl]pyrrolidin-1-yl]-2-methyl-pyridazin-3-one CAS Name: 6-[(3S,4R)-3-(5-chloro-2-pyridinyl)-4-[[(3R,5S)-4-hydroxy-4-(4-methoxyphenyl)-3,5-dimethyl-1-piperidinyl]-oxomethyl]-1-pyrrolidinyl]-2-methyl-3-pyridazinone IUPAC Name: 6-[(3S,4R)-3-(5-chloropyridin-2-yl)-4-[(3R,5S)-4-hydroxy-4-(4-methoxyphenyl)-3,5-dimethylpiperidine-1-carbonyl]pyrrolidin-1-yl]-2-methylpyridazin-3-one Traditional Name: 6-[(3S,4R)-3-(5-chloro-2-pyridyl)-4-[(3R,5S)-4-hydroxy-4-(4-methoxyphenyl)-3,5-dimethyl-piperidine-1-carbonyl]pyrrolidino]-2-methyl-pyridazin-3-one Formula: C29H34ClN5O4 MolecularWeight: 552.06436

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(C1(C2=CC=C(C=C2)OC)O)C)C(=O)C3CN(CC3C4=NC=C(C=C4)Cl)C5=NN(C(=O)C=C5)C

Isomeric SMILES

C[C@@H]1CN(C[C@@H](C1(C2=CC=C(C=C2)OC)O)C)C(=O)[C@H]3CN(C[C@H]3C4=NC=C(C=C4)Cl)C5=NN(C(=O)C=C5)C

InChI

InChI=1S/C29H34ClN5O4/c1-18-14-35(15-19(2)29(18,38)20-5-8-22(39-4)9-6-20)28(37)24-17-34(26-11-12-27(36)33(3)32-26)16-23(24)25-10-7-21(30)13-31-25/h5-13,18-19,23-24,38H,14-17H2,1-4H3/t18-,19+,23-,24+,29?/m1/s1