Vitas-M small molecule compound

methyl N-[(1E)-1-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)propyl]tryptophanate

Catalog ID
STK584994
SMILES COC(=O)C(Cc1c[nH]c2c1cccc2)N/C(=C/1\C(=NC(=NC1=O)O)O)/CC

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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 C19H20N4O5 MW 384.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O5/c1-3-12(15-16(24)22-19(27)23-17(15)25)21-14(18(26)28-2)8-10-9-20-13-7-5-4-6-11(10)13/h4-7,9,14,20-21H,3,8H2,1-2H3,(H2,22,23,24,25,27)
InChIKey
JUEXFRGQARFZCE-UHFFFAOYSA-N
Synonyms

CCC(=C1C(=O)NC(=O)NC1=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC
COC(=O)C(Cc1c(nH)c2c1cccc2)NC(=C1C(=NC(=NC1=O)O)O)CC
InChI=1SC19H20N4O5c1312(1516(24)2219(27)2317(15)25)2114(18(26)282)81092013754611(10)13h479142021H38H212H3(H22223242527)
METHYL3(1HINDOL3YL)2(1(246TRIOXO13DIAZINAN5YLIDENE)PROPYLAMINO)PROPANOATE
methylN((1E)1(26dihydroxy4oxopyrimidin5(4H)ylidene)propyl)tryptophanate
MFCD07200063
ZINC000101084595
ZINC000101084598

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Available files

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