Vitas-M small molecule compound
ethyl 4-{[(6-chloro-1,1-dioxido-4-phenyl-2H-1,2,3-benzothiadiazin-2-yl)acetyl]amino}benzoate
Catalog ID
STL082939
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CN1N=C(c2ccccc2)c2c(S1(=O)=O)ccc(c2)Cl
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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 C24H20ClN3O5S MW 497.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN3O5S/c1-2-33-24(30)17-8-11-19(12-9-17)26-22(29)15-28-27-23(16-6-4-3-5-7-16)20-14-18(25)10-13-21(20)34(28,31)32/h3-14H,2,15H2,1H3,(H,26,29)InChIKey
HSZBSLPOCNUWNR-UHFFFAOYSA-NSynonyms
1031554-81-01031554810
CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2N=C(C3=C(S2(=O)=O)C=CC(=C3)Cl)C4=CC=CC=C4
ethyl4(((6chloro11dioxido4phenyl2H123benzothiadiazin2yl)acetyl)amino)benzoate
ethyl4((2(6chloro11dioxo4phenyl1$l^(6)23benzothiadiazin2yl)acetyl)amino)benzoate
ETHYL4(2(6CHLORO11DIOXIDO4PHENYL2HBENZO(E)(123)THIADIAZIN2YL)ACETAMIDO)BENZOATE
InChI=1SC24H20ClN3O5Sc123324(30)1781119(12917)2622(29)15282723(166435716)201418(25)101321(20)34(2831)32h314H215H21H3(H2629)
MFCD15029044
ZINC000021942479
ZINC21942479
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