Vitas-M small molecule compound
3-(2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)-N-[(2E)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]propanamide
Catalog ID
STL314746
SMILES CC(Cc1n[nH]/c(=N\C(=O)CCC2NC(=O)c3c(N=C2O)cccc3)/s1)C
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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 C18H21N5O3S MW 387.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N5O3S/c1-10(2)9-15-22-23-18(27-15)21-14(24)8-7-13-17(26)19-12-6-4-3-5-11(12)16(25)20-13/h3-6,10,13H,7-9H2,1-2H3,(H,19,26)(H,20,25)(H,21,23,24)InChIKey
HLLKNMNSNOINKF-UHFFFAOYSA-NSynonyms
3(2hydroxy5oxo45dihydro3H14benzodiazepin3yl)N((2E)5(2methylpropyl)134thiadiazol2(3H)ylidene)propanamide
CC(Cc1n(nH)c(=NC(=O)CCC2NC(=O)c3c(N=C2O)cccc3)s1)C
MFCD28026858
ZINC000095476552
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