Vitas-M small molecule compound
2-{[1,3-dimethyl-2,6-dioxo-7-(3-phenylpropyl)-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}acetamide
Catalog ID
STK840354
SMILES NC(=O)CSc1nc2c(n1CCCc1ccccc1)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 C18H21N5O3S MW 387.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N5O3S/c1-21-15-14(16(25)22(2)18(21)26)23(17(20-15)27-11-13(19)24)10-6-9-12-7-4-3-5-8-12/h3-5,7-8H,6,9-11H2,1-2H3,(H2,19,24)InChIKey
QXIDLDIVSSZJRB-UHFFFAOYSA-NSynonyms
377066-94-92((13dimethyl26dioxo7(3phenylpropyl)2367tetrahydro1Hpurin8yl)sulfanyl)acetamide
2((13dimethyl26dioxo7(3phenylpropyl)2367tetrahydro1Hpurin8yl)thio)acetamide
2(13DIMETHYL26DIOXO7(3PHENYLPROPYL)137TRIHYDROPURIN8YLTHIO)ACETAMIDE
2(13DIMETHYL26DIOXO7(3PHENYLPROPYL)PURIN8YL)SULFANYLACETAMIDE
377066949
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCC(=O)N)CCCC3=CC=CC=C3
InChI=1SC18H21N5O3Sc1211514(16(25)22(2)18(21)26)23(17(2015)271113(19)24)1069127435812h3578H6911H212H3(H21924)
MFCD02737561
ZINC000000637483
ZINC00637483
ZINC637483
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