Vitas-M small molecule compound
2-(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)-N-[(2E)-4-ethyl-5-methyl-1,3-thiazol-2(3H)-ylidene]acetamide
Catalog ID
STL538675
SMILES CCc1[nH]/c(=N\C(=O)CN2C(=O)C3CCCN3C(=O)c3c2cccc3)/sc1C
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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 C20H22N4O3S MW 398.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O3S/c1-3-14-12(2)28-20(21-14)22-17(25)11-24-15-8-5-4-7-13(15)18(26)23-10-6-9-16(23)19(24)27/h4-5,7-8,16H,3,6,9-11H2,1-2H3,(H,21,22,25)InChIKey
HOHZXVOBQMBJQV-UHFFFAOYSA-NSynonyms
2(511dioxo231111atetrahydro1Hpyrrolo(21c)(14)benzodiazepin10(5H)yl)N((2E)4ethyl5methyl13thiazol2(3H)ylidene)acetamide
2(611dioxo6~(a)789tetrahydropyrrolo(21c)(14)benzodiazepin5yl)~(N)(4ethyl5methyl13thiazol2yl)acetamide
71963609
MFCD31754652
ZINC000072325529
ZINC000097531505
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