Vitas-M small molecule compound

6-{[(2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanoyl]amino}hexanoic acid

Catalog ID
STK610980
SMILES OC(=O)CCCCCNC(=O)[C@@H](n1nnc2c(c1=O)cccc2)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 C16H20N4O4 MW 332.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O4/c1-11(15(23)17-10-6-2-3-9-14(21)22)20-16(24)12-7-4-5-8-13(12)18-19-20/h4-5,7-8,11H,2-3,6,9-10H2,1H3,(H,17,23)(H,21,22)/t11-/m0/s1
InChIKey
JLDCBCSVNNFBMZ-NSHDSACASA-N
Synonyms
956044-69-2
(S)6(2(4oxobenzo(d)(123)triazin3(4H)yl)propanamido)hexanoicacid
6(((2S)2(4oxo123benzotriazin3(4H)yl)propanoyl)amino)hexanoicacid
6(((2S)2(4OXO123BENZOTRIAZIN3YL)PROPANOYL)AMINO)HEXANOICACID
6((S)2(4OXO4HBENZO(D)(123)TRIAZIN3YL)PROPIONYLAMINO)HEXANOICACID
956044692
CC(C(=O)NCCCCCC(=O)O)N1C(=O)C2=CC=CC=C2N=N1
InChI=1SC16H20N4O4c111(15(23)1710623914(21)22)2016(24)12745813(12)181920h457811H236910H21H3(H1723)(H2122)t11m0s1
MFCD06599916
OC(=O)CCCCCNC(=O)(C@@H)(n1nnc2c(c1=O)cccc2)C
ZINC000002221459
ZINC2221459

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Available files

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