(Q76755722)

English

N-[(1R,3S)-5-hydroxy-2-adamantyl]-6-(4-methylpiperazin-1-yl)-2-propylsulfanylpyridine-3-carboxamide

group of stereoisomers with the chemical formula C₂₄H₃₆N₄O₂S

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Statements

group of stereoisomers

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chemical compound

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444.25589739199995 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₄H₃₆N₄O₂S

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canonical SMILES

CCCSc1nc(N2CCN(C)CC2)ccc1C(=O)NC1C2CC3CC1CC(O)(C3)C2

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CCCSC1=C(C=CC(=N1)N2CCN(CC2)C)C(=O)NC3[C@@H]4CC5C[C@H]3CC(C4)(C5)O

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Identifiers

InChI=1S/C24H36N4O2S/c1-3-10-31-23-19(4-5-20(25-23)28-8-6-27(2)7-9-28)22(29)26-21-17-11-16-12-18(21)15-24(30,13-16)14-17/h4-5,16-18,21,30H,3,6-15H2,1-2H3,(H,26,29)/t16?,17-,18+,21?,24?

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HCCPSOBZLRHGQN-RWPHOMLFSA-N

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UniChem compound ID

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