Vitas-M small molecule compound
2-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)methyl]benzonitrile
Catalog ID
STK743537
SMILES N#Cc1ccccc1Cn1cnc2c1c(=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 C15H13N5O2 MW 295.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N5O2/c1-18-13-12(14(21)19(2)15(18)22)20(9-17-13)8-11-6-4-3-5-10(11)7-16/h3-6,9H,8H2,1-2H3InChIKey
GQKASNUZVOCVDJ-UHFFFAOYSA-NSynonyms
351365-59-82((13dimethyl26dioxo1236tetrahydro7Hpurin7yl)methyl)benzonitrile
2((13DIMETHYL26DIOXO137TRIHYDROPURIN7YL)METHYL)BENZENECARBONITRILE
2((13DIMETHYL26DIOXOPURIN7YL)METHYL)BENZONITRILE
351365598
CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC3=CC=CC=C3C#N
InChI=1SC15H13N5O2c1181312(14(21)19(2)15(18)22)20(91713)811643510(11)716h369H8H212H3
MFCD02734117
ZINC000000129544
ZINC00129544
ZINC129544
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