Vitas-M small molecule compound
methyl N-[(E)-(1-methyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]tryptophanate
Catalog ID
STK257550
SMILES COC(=O)C(Cc1c[nH]c2c1cccc2)N/C=C/1\C(=O)NC(=O)N(C1=O)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 C18H18N4O5 MW 370.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O5/c1-22-16(24)12(15(23)21-18(22)26)9-20-14(17(25)27-2)7-10-8-19-13-6-4-3-5-11(10)13/h3-6,8-9,14,19-20H,7H2,1-2H3,(H,21,23,26)/b12-9+InChIKey
MNMMERKRJHAMMN-FMIVXFBMSA-NSynonyms
(Z)methyl3(1Hindol3yl)2(((1methyl246trioxotetrahydropyrimidin5(2H)ylidene)methyl)amino)propanoate
CN1C(=O)C(=CNC(CC2=CNC3=CC=CC=C32)C(=O)OC)C(=O)NC1=O
COC(=O)C(Cc1c(nH)c2c1cccc2)NC=C1C(=O)NC(=O)N(C1=O)C
InChI=1SC18H18N4O5c12216(24)12(15(23)2118(22)26)92014(17(25)272)71081913643511(10)13h3689141920H7H212H3(H212326)b129+
methyl3(1Hindol3yl)2(((E)(1methyl246trioxo13diazinan5ylidene)methyl)amino)propanoate
methylN((E)(1methyl246trioxotetrahydropyrimidin5(2H)ylidene)methyl)tryptophanate
MFCD08685506
ZINC000005753353
ZINC000005753355
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