Vitas-M small molecule compound
N'-[(3E)-1-(2-bromoethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2-(6-hydroxy-3-methyl-2-oxo-2,3-dihydro-7H-purin-7-yl)acetohydrazide
Catalog ID
STK635309
SMILES BrCCN1C(=O)/C(=N/NC(=O)Cn2cnc3c2c(O)nc(=O)n3C)/c2c1cccc2
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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 C18H16BrN7O4 MW 474.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrN7O4/c1-24-15-14(16(28)21-18(24)30)25(9-20-15)8-12(27)22-23-13-10-4-2-3-5-11(10)26(7-6-19)17(13)29/h2-5,9H,6-8H2,1H3,(H,22,27)(H,21,28,30)/b23-13+InChIKey
PEBMIGQHGCXIIB-YDZHTSKRSA-NSynonyms
BrCCN1C(=O)C(=NNC(=O)Cn2cnc3c2c(O)nc(=O)n3C)c2c1cccc2
CN1C2=C(C(=O)NC1=O)N(C=N2)CC(=O)NN=C3C4=CC=CC=C4N(C3=O)CCBr
InChI=1SC18H16BrN7O4c1241514(16(28)2118(24)30)25(92015)812(27)22231310423511(10)26(7619)17(13)29h259H68H21H3(H2227)(H212830)b2313+
MFCD18160687
N((3E)1(2bromoethyl)2oxo12dihydro3Hindol3ylidene)2(6hydroxy3methyl2oxo23dihydro7Hpurin7yl)acetohydrazide
N((E)(1(2BROMOETHYL)2OXOINDOL3YLIDENE)AMINO)2(3METHYL26DIOXOPURIN7YL)ACETAMIDE
ZINC000008934223
ZINC100267401
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