Vitas-M small molecule compound
2-[(3R)-2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl]-N-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]acetamide
Catalog ID
STK943213
SMILES O=C(C[C@H]1NC(=O)c2c(N=C1O)cccc2)Nc1nnc(s1)CCc1ccccc1
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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 C21H19N5O3S MW 421.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O3S/c27-17(12-16-20(29)22-15-9-5-4-8-14(15)19(28)23-16)24-21-26-25-18(30-21)11-10-13-6-2-1-3-7-13/h1-9,16H,10-12H2,(H,22,29)(H,23,28)(H,24,26,27)/t16-/m1/s1InChIKey
MRCHQROSVIZILB-MRXNPFEDSA-NSynonyms
1246055-13-91246055139
2((3R)25dioxo34dihydro1H14benzodiazepin3yl)N(5(2phenylethyl)134thiadiazol2yl)acetamide
2((3R)2hydroxy5oxo45dihydro3H14benzodiazepin3yl)N(5(2phenylethyl)134thiadiazol2yl)acetamide
C1=CC=C(C=C1)CCC2=NN=C(S2)NC(=O)CC3C(=O)NC4=CC=CC=C4C(=O)N3
InChI=1SC21H19N5O3Sc2717(121620(29)2215954814(15)19(28)2316)2421262518(3021)1110136213713h1916H1012H2(H2229)(H2328)(H242627)t16m1s1
MFCD18180325
O=C(C(C@H)1NC(=O)c2c(N=C1O)cccc2)Nc1nnc(s1)CCc1ccccc1
ZINC000044921923
ZINC44921923
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