(Q76423166)

English

N-[(1S,5R)-8-[(4-chlorophenyl)methyl]-8-azabicyclo[3.2.1]octan-3-yl]-2-(dimethylamino)-4-methoxypyrimidine-5-carboxamide

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Statements

type of chemical entity

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chemical compound

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429.193152816 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₂H₂₈ClN₅O₂

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canonical SMILES

COc1nc(N(C)C)ncc1C(=O)NC1CC2CCC(C1)N2Cc1ccc(Cl)cc1

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CN(C)C1=NC=C(C(=N1)OC)C(=O)NC2C[C@H]3CC[C@@H](C2)N3CC4=CC=C(C=C4)Cl

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Identifiers

InChI=1S/C22H28ClN5O2/c1-27(2)22-24-12-19(21(26-22)30-3)20(29)25-16-10-17-8-9-18(11-16)28(17)13-14-4-6-15(23)7-5-14/h4-7,12,16-18H,8-11,13H2,1-3H3,(H,25,29)/t16?,17-,18+

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GEJOURLVTDCMJS-AYHJJNSGSA-N

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UniChem compound ID

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