Vitas-M small molecule compound
3-(2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)-N-{(1S)-2-methyl-1-[1-(propan-2-yl)-1H-benzimidazol-2-yl]propyl}propanamide
Catalog ID
STL542986
SMILES O=C(N[C@H](c1nc2c(n1C(C)C)cccc2)C(C)C)CCC1NC(=O)c2c(N=C1O)cccc2
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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 C26H31N5O3 MW 461.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N5O3/c1-15(2)23(24-27-19-11-7-8-12-21(19)31(24)16(3)4)30-22(32)14-13-20-26(34)28-18-10-6-5-9-17(18)25(33)29-20/h5-12,15-16,20,23H,13-14H2,1-4H3,(H,28,34)(H,29,33)(H,30,32)/t20?,23-/m0/s1InChIKey
MBYSLJMFXQYDKZ-AKRCKQFNSA-NSynonyms
3(25dioxo34dihydro1~(H)14benzodiazepin3yl)~(N)((1~(S))2methyl1(1propan2ylbenzimidazol2yl)propyl)propanamide
3(2hydroxy5oxo45dihydro3H14benzodiazepin3yl)N((1S)2methyl1(1(propan2yl)1Hbenzimidazol2yl)propyl)propanamide
91636993
InChI=1SC26H31N5O3c115(2)23(24271911781221(19)31(24)16(3)4)3022(32)14132026(34)28181065917(18)25(33)2920h51215162023H1314H214H3(H2834)(H2933)(H3032)t20?23m0s1
ZINC000217677444
ZINC000217677534
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