Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-N~3~-(2-chloro-7H-purin-6-yl)-beta-alaninamide
Catalog ID
STK631208
SMILES O=C(NCc1ccc2c(c1)OCO2)CCNc1nc(Cl)nc2c1[nH]cn2
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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 C16H15ClN6O3 MW 374.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15ClN6O3/c17-16-22-14(13-15(23-16)21-7-20-13)18-4-3-12(24)19-6-9-1-2-10-11(5-9)26-8-25-10/h1-2,5,7H,3-4,6,8H2,(H,19,24)(H2,18,20,21,22,23)InChIKey
KFCIZHYGMAGEGN-UHFFFAOYSA-NSynonyms
929842-96-6929842966
C1OC2=C(O1)C=C(C=C2)CNC(=O)CCNC3=NC(=NC4=C3NC=N4)Cl
InChI=1SC16H15ClN6O3c17162214(1315(2316)2172013)184312(24)1969121011(59)2682510h1257H3468H2(H1924)(H21820212223)
MFCD09797920
N(13benzodioxol5ylmethyl)3((2chloro7Hpurin6yl)amino)propanamide
N(13benzodioxol5ylmethyl)N~3~(2chloro7Hpurin6yl)betaalaninamide
N(13BENZODIOXOL5YLMETHYL)N3(2CHLORO7HPURIN6YL)BETAALANINAMIDE
N(benzo(d)(13)dioxol5ylmethyl)3((2chloro9Hpurin6yl)amino)propanamide
O=C(NCc1ccc2c(c1)OCO2)CCNc1nc(Cl)nc2c1(nH)cn2
O=C(NCc1ccc2c(c1)OCO2)CCNc1nc(Cl)nc2c1nc(nH)2
ZINC000013680776
ZINC13680776
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