Vitas-M small molecule compound
2-[7-(3-chlorobenzyl)-3,9-dimethyl-6,8-dioxo-6,7,8,9-tetrahydro[1,2,4]triazino[3,4-f]purin-1(4H)-yl]acetamide
Catalog ID
STL009174
SMILES NC(=O)CN1N=C(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1cccc(c1)Cl
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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 C18H18ClN7O3 MW 415.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN7O3/c1-10-7-24-14-15(21-17(24)26(22-10)9-13(20)27)23(2)18(29)25(16(14)28)8-11-4-3-5-12(19)6-11/h3-6H,7-9H2,1-2H3,(H2,20,27)InChIKey
JABVWLXRZNTAOJ-UHFFFAOYSA-NSynonyms
921141-51-72(7((3chlorophenyl)methyl)39dimethyl68dioxo4Hpurino(87c)(124)triazin1yl)acetamide
2(7((3CHLOROPHENYL)METHYL)39DIMETHYL68DIOXO579TRIHYDRO4H124TRIAZINO(43H)PURINYL)ACETAMIDE
2(7(3chlorobenzyl)39dimethyl68dioxo6789tetrahydro(124)triazino(34f)purin1(4H)yl)acetamide
921141517
CC1=NN(C2=NC3=C(N2C1)C(=O)N(C(=O)N3C)CC4=CC(=CC=C4)Cl)CC(=O)N
InChI=1SC18H18ClN7O3c1107241415(2117(24)26(2210)913(20)27)23(2)18(29)25(16(14)28)81143512(19)611h36H79H212H3(H22027)
MFCD08744320
ZINC000009059675
ZINC09059675
ZINC9059675
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