Vitas-M small molecule compound
butyl 4-(9H-purin-6-ylamino)benzoate
Catalog ID
STK944583
SMILES CCCCOC(=O)c1ccc(cc1)Nc1ncnc2c1nc[nH]2
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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 C16H17N5O2 MW 311.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N5O2/c1-2-3-8-23-16(22)11-4-6-12(7-5-11)21-15-13-14(18-9-17-13)19-10-20-15/h4-7,9-10H,2-3,8H2,1H3,(H2,17,18,19,20,21)InChIKey
FBUAXCTURSXZIJ-UHFFFAOYSA-NSynonyms
537666-83-4537666834
BUTYL4(7HPURIN6YLAMINO)BENZOATE
butyl4(9Hpurin6ylamino)benzoate
BUTYL4(PURIN6YLAMINO)BENZOATE
CCCCOC(=O)C1=CC=C(C=C1)NC2=NC=NC3=C2NC=N3
CCCCOC(=O)c1ccc(cc1)Nc1ncnc2c1nc(nH)2
InChI=1SC16H17N5O2c12382316(22)114612(7511)21151314(1891713)19102015h47910H238H21H3(H21718192021)
MFCD04991695
ZINC000002719602
ZINC02719602
ZINC2719602
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