Vitas-M small molecule compound
8-{(2E)-2-[4-(dimethylamino)benzylidene]hydrazinyl}-7-[2-hydroxy-3-(propan-2-yloxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK840236
SMILES OC(Cn1c(N/N=C/c2ccc(cc2)N(C)C)nc2c1c(=O)[nH]c(=O)n2C)COC(C)C
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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 C21H29N7O4 MW 443.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N7O4/c1-13(2)32-12-16(29)11-28-17-18(27(5)21(31)24-19(17)30)23-20(28)25-22-10-14-6-8-15(9-7-14)26(3)4/h6-10,13,16,29H,11-12H2,1-5H3,(H,23,25)(H,24,30,31)/b22-10+InChIKey
ZUMROTAQVRFEEU-LSHDLFTRSA-NSynonyms
375363-11-4(E)8(2(4(dimethylamino)benzylidene)hydrazinyl)7(2hydroxy3isopropoxypropyl)3methyl1Hpurine26(3H7H)dione
375363114
8((2E)2((4(dimethylamino)phenyl)methylidene)hydrazinyl)7(2hydroxy3propan2yloxypropyl)3methylpurine26dione
8((2E)2(4(dimethylamino)benzylidene)hydrazinyl)7(2hydroxy3(propan2yloxy)propyl)3methyl37dihydro1Hpurine26dione
CC(C)OCC(CN1C2=C(N=C1NN=CC3=CC=C(C=C3)N(C)C)N(C(=O)NC2=O)C)O
InChI=1SC21H29N7O4c113(2)321216(29)11281718(27(5)21(31)2419(17)30)2320(28)252210146815(9714)26(3)4h610131629H1112H215H3(H2325)(H243031)b2210+
MFCD02239255
OC(Cn1c(NN=Cc2ccc(cc2)N(C)C)nc2c1c(=O)(nH)c(=O)n2C)COC(C)C
ZINC000008970510
ZINC000008970512
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