2-(2-chloranyl-4-methoxy-phenyl)-3-ethyl-5-[(2S,4R)-4-methoxy-2-(methoxymethyl)pyrrolidin-1-yl]-6-methyl-pyrimidin-4-one

Systemtic Name: 2-(2-chloranyl-4-methoxy-phenyl)-3-ethyl-5-[(2S,4R)-4-methoxy-2-(methoxymethyl)pyrrolidin-1-yl]-6-methyl-pyrimidin-4-one Openeye Name: 2-(2-chloro-4-methoxy-phenyl)-3-ethyl-5-[(2S,4R)-4-methoxy-2-(methoxymethyl)pyrrolidin-1-yl]-6-methyl-pyrimidin-4-one CAS Name: 2-(2-chloro-4-methoxyphenyl)-3-ethyl-5-[(2S,4R)-4-methoxy-2-(methoxymethyl)-1-pyrrolidinyl]-6-methyl-4-pyrimidinone IUPAC Name: 2-(2-chloro-4-methoxyphenyl)-3-ethyl-5-[(2S,4R)-4-methoxy-2-(methoxymethyl)pyrrolidin-1-yl]-6-methylpyrimidin-4-one Traditional Name: 2-(2-chloro-4-methoxy-phenyl)-3-ethyl-5-[(2S,4R)-4-methoxy-2-(methoxymethyl)pyrrolidino]-6-methyl-pyrimidin-4-one Formula: C21H28ClN3O4 MolecularWeight: 421.91772

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC(=C(C1=O)N2CC(CC2COC)OC)C)C3=C(C=C(C=C3)OC)Cl

Isomeric SMILES

CCN1C(=NC(=C(C1=O)N2C[C@@H](C[C@H]2COC)OC)C)C3=C(C=C(C=C3)OC)Cl

InChI

InChI=1S/C21H28ClN3O4/c1-6-24-20(17-8-7-15(28-4)10-18(17)22)23-13(2)19(21(24)26)25-11-16(29-5)9-14(25)12-27-3/h7-8,10,14,16H,6,9,11-12H2,1-5H3/t14-,16+/m0/s1