Vitas-M small molecule compound
ethyl (2E)-2-{[(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetyl]imino}-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL538273
SMILES CCOC(=O)c1cs/c(=N/C(=O)CN2C(=O)C3CCCN3C(=O)c3c2cccc3)/[nH]1
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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 C20H20N4O5S MW 428.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O5S/c1-2-29-19(28)13-11-30-20(21-13)22-16(25)10-24-14-7-4-3-6-12(14)17(26)23-9-5-8-15(23)18(24)27/h3-4,6-7,11,15H,2,5,8-10H2,1H3,(H,21,22,25)InChIKey
DQNJWKHMAOLXIS-UHFFFAOYSA-NSynonyms
71831324
ethyl(2E)2(((511dioxo231111atetrahydro1Hpyrrolo(21c)(14)benzodiazepin10(5H)yl)acetyl)imino)23dihydro13thiazole4carboxylate
ethyl2((2(611dioxo6~(a)789tetrahydropyrrolo(21c)(14)benzodiazepin5yl)acetyl)amino)13thiazole4carboxylate
MFCD31754535
ZINC000072326277
ZINC000101413936
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