Vitas-M small molecule compound
3-(2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)-N-{3-[5-(methoxymethyl)-1H-1,2,4-triazol-3-yl]phenyl}propanamide
Catalog ID
STL407237
SMILES COCc1[nH]nc(n1)c1cccc(c1)NC(=O)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 C22H22N6O4 MW 434.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O4/c1-32-12-18-26-20(28-27-18)13-5-4-6-14(11-13)23-19(29)10-9-17-22(31)24-16-8-3-2-7-15(16)21(30)25-17/h2-8,11,17H,9-10,12H2,1H3,(H,23,29)(H,24,31)(H,25,30)(H,26,27,28)InChIKey
OIMYIUWTIKVYLQ-UHFFFAOYSA-NSynonyms
3(25dioxo34dihydro1H14benzodiazepin3yl)N(3(5(methoxymethyl)1H124triazol3yl)phenyl)propanamide
3(2hydroxy5oxo45dihydro3H14benzodiazepin3yl)N(3(5(methoxymethyl)1H124triazol3yl)phenyl)propanamide
COCc1(nH)nc(n1)c1cccc(c1)NC(=O)CCC1NC(=O)c2c(N=C1O)cccc2
COCC1=NC(=NN1)C2=CC(=CC=C2)NC(=O)CCC3C(=O)NC4=CC=CC=C4C(=O)N3
InChI=1SC22H22N6O4c13212182620(282718)1354614(1113)2319(29)1091722(31)2416832715(16)21(30)2517h281117H91012H21H3(H2329)(H2431)(H2530)(H262728)
MFCD30704648
ZINC000096118202
ZINC000169772641
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