Vitas-M small molecule compound
(2S,5R)-3-methyl-7-oxo-3-(1H-1,2,3-triazol-1-ylmethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 4,4-dioxide
Catalog ID
STK801890
SMILES OC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)Cn1ccnn1
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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 C10H12N4O5S MW 300.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H12N4O5S/c1-10(5-13-3-2-11-12-13)8(9(16)17)14-6(15)4-7(14)20(10,18)19/h2-3,7-8H,4-5H2,1H3,(H,16,17)/t7-,8+,10?/m1/s1InChIKey
LPQZKKCYTLCDGQ-HHCGNCNQSA-NSynonyms
1212488-56-6(2S5R)3((1H123TRIAZOL1YL)METHYL)3METHYL7OXO4THIA1AZABICYCLO(320)HEPTANE2CARBOXYLICACID44DIOXIDE
(2S5R)3methyl447trioxo3(triazol1ylmethyl)4$l^(6)thia1azabicyclo(320)heptane2carboxylicacid
(2S5R)3methyl7oxo3(1H123triazol1ylmethyl)4thia1azabicyclo(320)heptane2carboxylicacid44dioxide
1212488566
CC1(C(N2C(S1(=O)=O)CC2=O)C(=O)O)CN3C=CN=N3
InChI=1SC10H12N4O5Sc110(51332111213)8(9(16)17)146(15)47(14)20(1018)19h2378H45H21H3(H1617)t78+10?m1s1
MFCD09025606
OC(=O)(C@@H)1N2C(=O)C(C@H)2S(=O)(=O)C1(C)Cn1ccnn1
ZINC000003781867
ZINC000003787060
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