Vitas-M small molecule compound
1,3-dimethyl-7-(3-methylbenzyl)-8-{[3-(propan-2-yloxy)propyl]amino}-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK262491
SMILES CC(OCCCNc1nc2c(n1Cc1cccc(c1)C)c(=O)n(c(=O)n2C)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 C21H29N5O3 MW 399.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N5O3/c1-14(2)29-11-7-10-22-20-23-18-17(19(27)25(5)21(28)24(18)4)26(20)13-16-9-6-8-15(3)12-16/h6,8-9,12,14H,7,10-11,13H2,1-5H3,(H,22,23)InChIKey
FMTLOFMISYCMFX-UHFFFAOYSA-NSynonyms
13DIMETHYL7((3METHYLPHENYL)METHYL)8(3PROPAN2YLOXYPROPYLAMINO)PURINE26DIONE
13dimethyl7(3methylbenzyl)8((3(propan2yloxy)propyl)amino)37dihydro1Hpurine26dione
13DIMETHYL8((3(METHYLETHOXY)PROPYL)AMINO)7((3METHYLPHENYL)METHYL)137TRIHYDROPURINE26DIONE
8((3ISOPROPOXYPROPYL)AMINO)13DIMETHYL7(3METHYLBENZYL)37DIHYDRO1HPURINE26DIONE
CC1=CC(=CC=C1)CN2C3=C(N=C2NCCCOC(C)C)N(C(=O)N(C3=O)C)C
InChI=1SC21H29N5O3c114(2)29117102220231817(19(27)25(5)21(28)24(18)4)26(20)131696815(3)1216h6891214H7101113H215H3(H2223)
MFCD07620975
ZINC000004818304
ZINC04818304
ZINC4818304
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