Vitas-M small molecule compound
8-(4-ethylpiperazin-1-yl)-1,3-dimethyl-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL006164
SMILES CCN1CCN(CC1)c1nc2c(n1CCSc1nnnn1c1ccccc1)c(=O)n(c(=O)n2C)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 C22H28N10O2S MW 496.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N10O2S/c1-4-29-10-12-30(13-11-29)20-23-18-17(19(33)28(3)22(34)27(18)2)31(20)14-15-35-21-24-25-26-32(21)16-8-6-5-7-9-16/h5-9H,4,10-15H2,1-3H3InChIKey
HZJROAKXRAQFLM-UHFFFAOYSA-NSynonyms
685860-80-4685860804
8(4ethylpiperazin1yl)13dimethyl7(2((1phenyl1Htetrazol5yl)sulfanyl)ethyl)37dihydro1Hpurine26dione
8(4ETHYLPIPERAZIN1YL)13DIMETHYL7(2((1PHENYL1HTETRAZOL5YL)THIO)ETHYL)1HPURINE26(3H7H)DIONE
8(4ETHYLPIPERAZIN1YL)13DIMETHYL7(2(1PHENYLTETRAZOL5YL)SULFANYLETHYL)PURINE26DIONE
CCN1CCN(CC1)C2=NC3=C(N2CCSC4=NN=NN4C5=CC=CC=C5)C(=O)N(C(=O)N3C)C
InChI=1SC22H28N10O2Sc1429101230(131129)20231817(19(33)28(3)22(34)27(18)2)31(20)1415352124252632(21)168657916h59H41015H213H3
MFCD04163104
ZINC000009280837
ZINC9280837
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