Vitas-M small molecule compound

3-methyl-7-(naphthalen-1-ylmethyl)-8-(propylamino)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL004517
SMILES CCCNc1nc2c(n1Cc1cccc3c1cccc3)c(=O)[nH]c(=O)n2C

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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 C20H21N5O2 MW 363.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O2/c1-3-11-21-19-22-17-16(18(26)23-20(27)24(17)2)25(19)12-14-9-6-8-13-7-4-5-10-15(13)14/h4-10H,3,11-12H2,1-2H3,(H,21,22)(H,23,26,27)
InChIKey
RBUAMIHVRKNMAG-UHFFFAOYSA-N
Synonyms
476480-62-3
3METHYL7(NAPHTHALEN1YLMETHYL)8(PROPYLAMINO)1HPURINE26(3H7H)DIONE
3methyl7(naphthalen1ylmethyl)8(propylamino)37dihydro1Hpurine26dione
3METHYL7(NAPHTHALEN1YLMETHYL)8(PROPYLAMINO)PURINE26DIONE
3METHYL7NAPHTHALEN1YLMETHYL8PROPYLAMINO37DIHYDROPURINE26DIONE
476480623
CCCNC1=NC2=C(N1CC3=CC=CC4=CC=CC=C43)C(=O)NC(=O)N2C
CCCNc1nc2c(n1Cc1cccc3c1cccc3)c(=O)(nH)c(=O)n2C
InChI=1SC20H21N5O2c13112119221716(18(26)2320(27)24(17)2)25(19)1214968137451015(13)14h410H31112H212H3(H2122)(H232627)
MFCD03933607
ZINC000001858352
ZINC01858352
ZINC1858352

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Available files

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