Vitas-M small molecule compound
N-[(2S)-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanoyl]-beta-alanine
Catalog ID
STK716991
SMILES OC(=O)CCNC(=O)[C@@H](n1nnc2c(c1=O)cccc2)C(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 C15H18N4O4 MW 318.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N4O4/c1-9(2)13(14(22)16-8-7-12(20)21)19-15(23)10-5-3-4-6-11(10)17-18-19/h3-6,9,13H,7-8H2,1-2H3,(H,16,22)(H,20,21)/t13-/m0/s1InChIKey
HEPFABKZBBGERM-ZDUSSCGKSA-NSynonyms
1173680-23-3(S)3(3methyl2(4oxobenzo(d)(123)triazin3(4H)yl)butanamido)propanoicacid
1173680233
3(((2S)3METHYL2(4OXO123BENZOTRIAZIN3YL)BUTANOYL)AMINO)PROPANOICACID
CC(C)C(C(=O)NCCC(=O)O)N1C(=O)C2=CC=CC=C2N=N1
InChI=1SC15H18N4O4c19(2)13(14(22)168712(20)21)1915(23)10534611(10)171819h36913H78H212H3(H1622)(H2021)t13m0s1
MFCD06597209
N((2S)3methyl2(4oxo123benzotriazin3(4H)yl)butanoyl)betaalanine
OC(=O)CCNC(=O)(C@@H)(n1nnc2c(c1=O)cccc2)C(C)C
ZINC000002208104
ZINC2208104
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