Vitas-M small molecule compound
1-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-3,4,7,9-tetramethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Catalog ID
STL350917
SMILES Clc1cccc(c1)N1CCN(CC1)CCN1N=C(C)C(n2c1nc1c2c(=O)n(c(=O)n1C)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 C23H29ClN8O2 MW 484.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29ClN8O2/c1-15-16(2)32-19-20(27(3)23(34)28(4)21(19)33)25-22(32)31(26-15)13-10-29-8-11-30(12-9-29)18-7-5-6-17(24)14-18/h5-7,14,16H,8-13H2,1-4H3InChIKey
TWCZOSKTKZWMCQ-UHFFFAOYSA-NSynonyms
923167-94-61(2(4(3chlorophenyl)piperazin1yl)ethyl)3479tetramethyl14dihydro(124)triazino(34f)purine68(7H9H)dione
1(2(4(3chlorophenyl)piperazin1yl)ethyl)3479tetramethyl4Hpurino(87c)(124)triazine68dione
1(2(4(3chlorophenyl)piperazin1yl)ethyl)3479tetramethyl79dihydro(124)triazino(34f)purine68(1H4H)dione
923167946
CC1C(=NN(C2=NC3=C(N12)C(=O)N(C(=O)N3C)C)CCN4CCN(CC4)C5=CC(=CC=C5)Cl)C
InChI=1SC23H29ClN8O2c11516(2)321920(27(3)23(34)28(4)21(19)33)2522(32)31(2615)13102981130(12929)1875617(24)1418h571416H813H214H3
MFCD09003203
ZINC000061971805
ZINC000061971806
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