Vitas-M small molecule compound
[1-({[(2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanoyl]amino}methyl)cyclohexyl]acetic acid
Catalog ID
STK716989
SMILES OC(=O)CC1(CCCCC1)CNC(=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 C19H24N4O4 MW 372.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24N4O4/c1-13(23-18(27)14-7-3-4-8-15(14)21-22-23)17(26)20-12-19(11-16(24)25)9-5-2-6-10-19/h3-4,7-8,13H,2,5-6,9-12H2,1H3,(H,20,26)(H,24,25)/t13-/m0/s1InChIKey
PLNLZJKEJPFNCB-ZDUSSCGKSA-NSynonyms
(1((((2S)2(4oxo123benzotriazin3(4H)yl)propanoyl)amino)methyl)cyclohexyl)aceticacid
2(1((((2S)2(4OXO123BENZOTRIAZIN3YL)PROPANOYL)AMINO)METHYL)CYCLOHEXYL)ACETICACID
2(1((2(4oxobenzo(d)(123)triazin3(4H)yl)propanamido)methyl)cyclohexyl)aceticacid
CC(C(=O)NCC1(CCCCC1)CC(=O)O)N2C(=O)C3=CC=CC=C3N=N2
InChI=1SC19H24N4O4c113(2318(27)14734815(14)212223)17(26)201219(1116(24)25)95261019h347813H256912H21H3(H2026)(H2425)t13m0s1
MFCD13371563
OC(=O)CC1(CCCCC1)CNC(=O)(C@@H)(n1nnc2c(c1=O)cccc2)C
OC(=O)CC1(CCCCC1)CNC(=O)C(n1nnc2c(c1=O)cccc2)C
ZINC000006760721
ZINC6760721
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