Vitas-M small molecule compound
methyl (1,1-dioxido-4-oxo-2-phenyl-3,4-dihydro-1,2,5-benzothiadiazepin-5(2H)-yl)acetate
Catalog ID
STL387548
SMILES COC(=O)CN1C(=O)CN(S(=O)(=O)c2c1cccc2)c1ccccc1
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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 C17H16N2O5S MW 360.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O5S/c1-24-17(21)12-18-14-9-5-6-10-15(14)25(22,23)19(11-16(18)20)13-7-3-2-4-8-13/h2-10H,11-12H2,1H3InChIKey
MIJXGTWOPXDEOB-UHFFFAOYSA-NSynonyms
COC(=O)CN1C(=O)CN(S(=O)(=O)C2=CC=CC=C21)C3=CC=CC=C3
InChI=1SC17H16N2O5Sc12417(21)1218149561015(14)25(2223)19(1116(18)20)137324813h210H1112H21H3
methyl(11dioxido4oxo2phenyl34dihydro125benzothiadiazepin5(2H)yl)acetate
METHYL2(114TRIOXO2PHENYL3H1
methyl2(114trioxo2phenyl3H1$l^(6)25benzothiadiazepin5yl)acetate
MFCD07791375
ZINC000004988628
ZINC04988628
ZINC4988628
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