Vitas-M small molecule compound
3-(4-chlorophenyl)-5,7-dimethyl-9-(3-methylbutyl)-5,9-dihydro-6H-[1,2,4]triazolo[4,3-e]purine-6,8(7H)-dione
Catalog ID
STL161200
SMILES CC(CCn1c2c(=O)n(C)c(=O)n(c2n2c1nnc2c1ccc(cc1)Cl)C)C
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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 C19H21ClN6O2 MW 400.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClN6O2/c1-11(2)9-10-25-14-16(23(3)19(28)24(4)17(14)27)26-15(21-22-18(25)26)12-5-7-13(20)8-6-12/h5-8,11H,9-10H2,1-4H3InChIKey
SIBMOBYVDBTFSC-UHFFFAOYSA-NSynonyms
921786-02-93(4chlorophenyl)57dimethyl9(3methylbutyl)59dihydro6H(124)triazolo(43e)purine68(7H)dione
3(4CHLOROPHENYL)9ISOPENTYL57DIMETHYL5H(124)TRIAZOLO(43E)PURINE68(7H9H)DIONE
8(4chlorophenyl)13dimethyl5(3methylbutyl)purino(89c)(124)triazole24dione
921786029
CC(C)CCN1C2=C(N(C(=O)N(C2=O)C)C)N3C1=NN=C3C4=CC=C(C=C4)Cl
InChI=1SC19H21ClN6O2c111(2)910251416(23(3)19(28)24(4)17(14)27)2615(212218(25)26)125713(20)8612h5811H910H214H3
MFCD08934236
ZINC000010968432
ZINC10968432
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