Vitas-M small molecule compound
7-(2-chloro-5-methoxybenzyl)-1,3-dimethyl-8-[(pyridin-2-ylmethyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK804441
SMILES COc1ccc(c(c1)Cn1c(NCc2ccccn2)nc2c1c(=O)n(c(=O)n2C)C)Cl
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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 C21H21ClN6O3 MW 440.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN6O3/c1-26-18-17(19(29)27(2)21(26)30)28(12-13-10-15(31-3)7-8-16(13)22)20(25-18)24-11-14-6-4-5-9-23-14/h4-10H,11-12H2,1-3H3,(H,24,25)InChIKey
ZIRJDLACNFPJPF-UHFFFAOYSA-NSynonyms
847847-01-27((2CHLORO5METHOXYPHENYL)METHYL)13DIMETHYL8(PYRIDIN2YLMETHYLAMINO)PURINE26DIONE
7(2CHLORO5METHOXYBENZYL)13DIMETHYL8((2PYRIDINYLMETHYL)AMINO)37DIHYDRO1HPURINE26DIONE
7(2chloro5methoxybenzyl)13dimethyl8((pyridin2ylmethyl)amino)1Hpurine26(3H7H)dione
7(2chloro5methoxybenzyl)13dimethyl8((pyridin2ylmethyl)amino)37dihydro1Hpurine26dione
847847012
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCC3=CC=CC=N3)CC4=C(C=CC(=C4)OC)Cl
InChI=1SC21H21ClN6O3c1261817(19(29)27(2)21(26)30)28(12131015(313)7816(13)22)20(2518)24111464592314h410H1112H213H3(H2425)
MFCD06603704
ZINC000001069440
ZINC01069440
ZINC1069440
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