Vitas-M small molecule compound
2-benzyl-1,1-dioxido-3-(phenylcarbonyl)-2H-1,2-benzothiazin-4-yl (2,5-dioxopyrrolidin-1-yl)acetate
Catalog ID
STL443983
SMILES O=C(OC1=C(C(=O)c2ccccc2)N(Cc2ccccc2)S(=O)(=O)c2c1cccc2)CN1C(=O)CCC1=O
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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 C28H22N2O7S MW 530.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N2O7S/c31-23-15-16-24(32)29(23)18-25(33)37-28-21-13-7-8-14-22(21)38(35,36)30(17-19-9-3-1-4-10-19)26(28)27(34)20-11-5-2-6-12-20/h1-14H,15-18H2InChIKey
IJSFVDFUSHWCPQ-UHFFFAOYSA-NSynonyms
899024-54-5(3benzoyl2benzyl11dioxo1$l^(6)2benzothiazin4yl)2(25dioxopyrrolidin1yl)acetate
2benzyl11dioxido3(phenylcarbonyl)2H12benzothiazin4yl(25dioxopyrrolidin1yl)acetate
899024545
C1CC(=O)N(C1=O)CC(=O)OC2=C(N(S(=O)(=O)C3=CC=CC=C32)CC4=CC=CC=C4)C(=O)C5=CC=CC=C5
InChI=1SC28H22N2O7Sc3123151624(32)29(23)1825(33)37282113781422(21)38(3536)30(171993141019)26(28)27(34)20115261220h114H1518H2
MFCD06239945
ZINC000001413541
ZINC1413541
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