Vitas-M small molecule compound

1,7-dibenzyl-8-{(2E)-2-[4-(dimethylamino)benzylidene]hydrazinyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK984056
SMILES CN(c1ccc(cc1)/C=N/Nc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1)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 C29H29N7O2 MW 507.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N7O2/c1-33(2)24-16-14-21(15-17-24)18-30-32-28-31-26-25(35(28)19-22-10-6-4-7-11-22)27(37)36(29(38)34(26)3)20-23-12-8-5-9-13-23/h4-18H,19-20H2,1-3H3,(H,31,32)/b30-18+
InChIKey
IYBCSTPJLQZPMX-UXHLAJHPSA-N
Synonyms

(E)17dibenzyl8(2(4(dimethylamino)benzylidene)hydrazinyl)3methyl1Hpurine26(3H7H)dione
17dibenzyl8((2E)2((4(dimethylamino)phenyl)methylidene)hydrazinyl)3methylpurine26dione
17dibenzyl8((2E)2(4(dimethylamino)benzylidene)hydrazinyl)3methyl37dihydro1Hpurine26dione
CN(c1ccc(cc1)C=NNc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1)C
CN1C2=C(C(=O)N(C1=O)CC3=CC=CC=C3)N(C(=N2)NN=CC4=CC=C(C=C4)N(C)C)CC5=CC=CC=C5
InChI=1SC29H29N7O2c133(2)24161421(151724)18303228312625(35(28)1922106471122)27(37)36(29(38)34(26)3)2023128591323h418H1920H213H3(H3132)b3018+
MFCD02988753
ZINC000009088229
ZINC97411173

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Available files

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