Vitas-M small molecule compound
2-(2-hydroxy-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)-N-[(2E)-5-(tetrahydrofuran-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Catalog ID
STL314870
SMILES O=C(CC1NC(=O)c2c(N=C1O)cccc2)/N=c/1\[nH]nc(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)InChIKey
MLIIGWXVSZDFCB-UHFFFAOYSA-NSynonyms
2(2hydroxy5oxo45dihydro3H14benzodiazepin3yl)N((2E)5(tetrahydrofuran2yl)134thiadiazol2(3H)ylidene)acetamide
MFCD28026924
O=C(CC1NC(=O)c2c(N=C1O)cccc2)N=c1(nH)nc(s1)C1CCCO1
ZINC000095476643
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