Vitas-M small molecule compound
N-benzyl-2-[(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide
Catalog ID
STK011909
SMILES O=C(NCc1ccccc1)CSc1nc2c([nH]1)n(C)c(=O)n(c2=O)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 C16H17N5O3S MW 359.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N5O3S/c1-20-13-12(14(23)21(2)16(20)24)18-15(19-13)25-9-11(22)17-8-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,17,22)(H,18,19)InChIKey
UEEZYDHTQFDBRX-UHFFFAOYSA-NSynonyms
2(13DIMETHYL26DIOXO(137TRIHYDROPURIN8YLTHIO))NBENZYLACETAMIDE
CN1C2=C(C(=O)N(C1=O)C)NC(=N2)SCC(=O)NCC3=CC=CC=C3
InChI=1SC16H17N5O3Sc1201312(14(23)21(2)16(20)24)1815(1913)25911(22)178106435710h37H89H212H3(H1722)(H1819)
MFCD18157757
Nbenzyl2((13dimethyl26dioxo2369tetrahydro1Hpurin8yl)sulfanyl)acetamide
Nbenzyl2((13dimethyl26dioxo7Hpurin8yl)sulfanyl)acetamide
O=C(NCc1ccccc1)CSc1nc2c((nH)1)n(C)c(=O)n(c2=O)C
STK011909
ZINC000101159020
ZINC101159020
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