Vitas-M small molecule compound
N-benzyl-Nalpha-{[(2R)-3,3-dimethyl-4,4-dioxido-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-yl]carbonyl}-L-tryptophanamide
Catalog ID
STL532451
SMILES O=C([C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H]1N2C(=O)CC2S(=O)(=O)C1(C)C)NCc1ccccc1
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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 C26H28N4O5S MW 508.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O5S/c1-26(2)23(30-21(31)13-22(30)36(26,34)35)25(33)29-20(24(32)28-14-16-8-4-3-5-9-16)12-17-15-27-19-11-7-6-10-18(17)19/h3-11,15,20,22-23,27H,12-14H2,1-2H3,(H,28,32)(H,29,33)/t20-,22?,23+/m0/s1InChIKey
BVLVIFMBEXJMPU-XLSWHLDHSA-NSynonyms
956994-21-1(2~(R))~(N)((2~(S))1(benzylamino)3(1~(H)indol3yl)1oxopropan2yl)33dimethyl447trioxo4$l^(6)thia1azabicyclo(320)heptane2carboxamide
(2R)N((S)1(benzylamino)3(1Hindol3yl)1oxopropan2yl)33dimethyl7oxo4thia1azabicyclo(320)heptane2carboxamide44dioxide
16406244
956994211
InChI=1SC26H28N4O5Sc126(2)23(3021(31)1322(30)36(2634)35)25(33)2920(24(32)2814168435916)121715271911761018(17)19h3111520222327H1214H212H3(H2832)(H2933)t2022?23+m0s1
NbenzylNalpha(((2R)33dimethyl44dioxido7oxo4thia1azabicyclo(320)hept2yl)carbonyl)Ltryptophanamide
O=C((C@H)(Cc1c(nH)c2c1cccc2)NC(=O)(C@H)1N2C(=O)CC2S(=O)(=O)C1(C)C)NCc1ccccc1
ZINC000008876399
ZINC000008876402
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