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

Systemtic Name: 6-[(3R,4S)-3-(5-chloranylpyridin-2-yl)-4-[(3R,5S)-4-(4-chlorophenyl)-3,5-dimethyl-4-oxidanyl-piperidin-1-yl]carbonyl-pyrrolidin-1-yl]-2-methyl-pyridazin-3-one Openeye Name: 6-[(3S,4R)-3-[(3R,5S)-4-(4-chlorophenyl)-4-hydroxy-3,5-dimethyl-piperidine-1-carbonyl]-4-(5-chloro-2-pyridyl)pyrrolidin-1-yl]-2-methyl-pyridazin-3-one CAS Name: 6-[(3S,4R)-3-[[(3R,5S)-4-(4-chlorophenyl)-4-hydroxy-3,5-dimethyl-1-piperidinyl]-oxomethyl]-4-(5-chloro-2-pyridinyl)-1-pyrrolidinyl]-2-methyl-3-pyridazinone IUPAC Name: 6-[(3S,4R)-3-[(3R,5S)-4-(4-chlorophenyl)-4-hydroxy-3,5-dimethylpiperidine-1-carbonyl]-4-(5-chloropyridin-2-yl)pyrrolidin-1-yl]-2-methylpyridazin-3-one Traditional Name: 6-[(3S,4R)-3-[(3R,5S)-4-(4-chlorophenyl)-4-hydroxy-3,5-dimethyl-piperidine-1-carbonyl]-4-(5-chloro-2-pyridyl)pyrrolidino]-2-methyl-pyridazin-3-one Formula: C28H31Cl2N5O3 MolecularWeight: 556.48344

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(C1(C2=CC=C(C=C2)Cl)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)Cl)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/C28H31Cl2N5O3/c1-17-13-35(14-18(2)28(17,38)19-4-6-20(29)7-5-19)27(37)23-16-34(25-10-11-26(36)33(3)32-25)15-22(23)24-9-8-21(30)12-31-24/h4-12,17-18,22-23,38H,13-16H2,1-3H3/t17-,18+,22-,23+,28?/m0/s1