Vitas-M small molecule compound

1-[1-(3-bromobenzyl)-3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]piperidine-4-carboxamide

Catalog ID
STL339265
SMILES NC(=O)C1CCN(CC1)c1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1cccc(c1)Br

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C20H23BrN6O3 MW 475.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23BrN6O3/c1-24-15-17(23-19(24)26-8-6-13(7-9-26)16(22)28)25(2)20(30)27(18(15)29)11-12-4-3-5-14(21)10-12/h3-5,10,13H,6-9,11H2,1-2H3,(H2,22,28)
InChIKey
GYPCOXPCDHSNDK-UHFFFAOYSA-N
Synonyms
840514-28-5
1(1((3BROMOPHENYL)METHYL)37DIMETHYL26BIS(OXIDANYLIDENE)PURIN8YL)PIPERIDINE4CARBOXAMIDE
1(1((3BROMOPHENYL)METHYL)37DIMETHYL26DIOXO8PURINYL)4PIPERIDINECARBOXAMIDE
1(1((3BROMOPHENYL)METHYL)37DIMETHYL26DIOXOPURIN8YL)PIPERIDINE4CARBOXAMIDE
1(1(3BROMOBENZYL)26DIKETO37DIMETHYLPURIN8YL)ISONIPECOTAMIDE
1(1(3bromobenzyl)37dimethyl26dioxo2367tetrahydro1Hpurin8yl)piperidine4carboxamide
840514285
CN1C2=C(N=C1N3CCC(CC3)C(=O)N)N(C(=O)N(C2=O)CC4=CC(=CC=C4)Br)C
InChI=1SC20H23BrN6O3c1241517(2319(24)268613(7926)16(22)28)25(2)20(30)27(18(15)29)111243514(21)1012h351013H6911H212H3(H22228)
MFCD04010033
ZINC000037866312
ZINC37866312

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Available files

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