Vitas-M small molecule compound

N~5~-carbamoyl-N~2~-[(2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanoyl]-L-ornithine

Catalog ID
STK716987
SMILES NC(=O)NCCC[C@@H](C(=O)O)NC(=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 C16H20N6O5 MW 376.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N6O5/c1-9(22-14(24)10-5-2-3-6-11(10)20-21-22)13(23)19-12(15(25)26)7-4-8-18-16(17)27/h2-3,5-6,9,12H,4,7-8H2,1H3,(H,19,23)(H,25,26)(H3,17,18,27)/t9-,12-/m0/s1
InChIKey
YKIWTIOOYWYIIJ-CABZTGNLSA-N
Synonyms
1014088-57-3
(2S)5(CARBAMOYLAMINO)2(((2S)2(4OXO123BENZOTRIAZIN3YL)PROPANOYL)AMINO)PENTANOICACID
(S)2((S)2(4oxobenzo(d)(123)triazin3(4H)yl)propanamido)5ureidopentanoicacid
1014088573
CC(C(=O)NC(CCCNC(=O)N)C(=O)O)N1C(=O)C2=CC=CC=C2N=N1
InChI=1SC16H20N6O5c19(2214(24)10523611(10)202122)13(23)1912(15(25)26)7481816(17)27h2356912H478H21H3(H1923)(H2526)(H3171827)t912m0s1
MFCD06596153
N~5~carbamoylN~2~((2S)2(4oxo123benzotriazin3(4H)yl)propanoyl)Lornithine
N5CARBAMOYLN2((2S)2(4OXO123BENZOTRIAZIN3(4H)YL)PROPANOYL)LORNITHINE
NC(=O)NCCC(C@@H)(C(=O)O)NC(=O)(C@@H)(n1nnc2c(c1=O)cccc2)C
ZINC000002203368
ZINC2203368

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Available files

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