Vitas-M small molecule compound
N~3~-(2-chloro-7H-purin-6-yl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-beta-alaninamide
Catalog ID
STL318076
SMILES O=C(NCc1c(C)nn(c1C)C)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 C15H19ClN8O MW 362.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19ClN8O/c1-8-10(9(2)24(3)23-8)6-18-11(25)4-5-17-13-12-14(20-7-19-12)22-15(16)21-13/h7H,4-6H2,1-3H3,(H,18,25)(H2,17,19,20,21,22)InChIKey
WCJSBXGQLMVNFO-UHFFFAOYSA-NSynonyms
1435901-64-61435901646
3((2chloro7Hpurin6yl)amino)N((135trimethylpyrazol4yl)methyl)propanamide
3((2chloro9Hpurin6yl)amino)N((135trimethyl1Hpyrazol4yl)methyl)propanamide
CC1=C(C(=NN1C)C)CNC(=O)CCNC2=NC(=NC3=C2NC=N3)Cl
InChI=1SC15H19ClN8Oc1810(9(2)24(3)238)61811(25)4517131214(2071912)2215(16)2113h7H46H213H3(H1825)(H21719202122)
MFCD28031079
N~3~(2chloro7Hpurin6yl)N((135trimethyl1Hpyrazol4yl)methyl)betaalaninamide
N3(2CHLORO7HPURIN6YL)N((135TRIMETHYL1HPYRAZOL4YL)METHYL)BETAALANINAMIDE
O=C(NCc1c(C)nn(c1C)C)CCNc1nc(Cl)nc2c1(nH)cn2
O=C(NCc1c(C)nn(c1C)C)CCNc1nc(Cl)nc2c1nc(nH)2
ZINC000095479013
ZINC95479013
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