Vitas-M small molecule compound
1,3-dimethyl-7-(4-methylbenzyl)-8-[(thiophen-2-ylmethyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK262530
SMILES Cc1ccc(cc1)Cn1c(NCc2cccs2)nc2c1c(=O)n(C)c(=O)n2C
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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 C20H21N5O2S MW 395.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O2S/c1-13-6-8-14(9-7-13)12-25-16-17(23(2)20(27)24(3)18(16)26)22-19(25)21-11-15-5-4-10-28-15/h4-10H,11-12H2,1-3H3,(H,21,22)InChIKey
BRSSGIVSUGTVDJ-UHFFFAOYSA-NSynonyms
13DIMETHYL7((4METHYLPHENYL)METHYL)8((2THIENYLMETHYL)AMINO)137TRIHYDROPURINE26DIONE
13DIMETHYL7((4METHYLPHENYL)METHYL)8(THIOPHEN2YLMETHYLAMINO)PURINE26DIONE
13DIMETHYL7(4METHYLBENZYL)8((THIEN2YLMETHYL)AMINO)37DIHYDRO1HPURINE26DIONE
13dimethyl7(4methylbenzyl)8((thiophen2ylmethyl)amino)37dihydro1Hpurine26dione
CC1=CC=C(C=C1)CN2C3=C(N=C2NCC4=CC=CS4)N(C(=O)N(C3=O)C)C
InChI=1SC20H21N5O2Sc1136814(9713)12251617(23(2)20(27)24(3)18(16)26)2219(25)21111554102815h410H1112H213H3(H2122)
MFCD07620999
ZINC000004818319
ZINC04818319
ZINC4818319
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