Vitas-M small molecule compound
2-[(3R)-2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl]-N-[5-(tetrahydrofuran-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
Catalog ID
STK939908
SMILES O=C(C[C@H]1NC(=O)c2c(N=C1O)cccc2)Nc1nnc(s1)C1CCCO1
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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 C17H17N5O4S MW 387.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N5O4S/c23-13(20-17-22-21-16(27-17)12-6-3-7-26-12)8-11-15(25)18-10-5-2-1-4-9(10)14(24)19-11/h1-2,4-5,11-12H,3,6-8H2,(H,18,25)(H,19,24)(H,20,22,23)/t11-,12?/m1/s1InChIKey
MLIIGWXVSZDFCB-JHJMLUEUSA-NSynonyms
1246036-40-71246036407
2((3R)25dioxo34dihydro1H14benzodiazepin3yl)N(5(oxolan2yl)134thiadiazol2yl)acetamide
2((3R)2hydroxy5oxo45dihydro3H14benzodiazepin3yl)N(5(tetrahydrofuran2yl)134thiadiazol2yl)acetamide
C1CC(OC1)C2=NN=C(S2)NC(=O)CC3C(=O)NC4=CC=CC=C4C(=O)N3
InChI=1SC17H17N5O4Sc2313(2017222116(2717)126372612)81115(25)181052149(10)14(24)1911h12451112H368H2(H1825)(H1924)(H202223)t1112?m1s1
MFCD18179383
O=C(C(C@H)1NC(=O)c2c(N=C1O)cccc2)Nc1nnc(s1)C1CCCO1
ZINC000044918041
ZINC000044918047
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