Vitas-M small molecule compound
4-{[1,1-dioxido-3-(phenylcarbonyl)-2H-1,2-benzothiazin-4-yl]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STK014167
SMILES O=C(C1=C(Nc2c(=O)n(n(c2C)C)c2ccccc2)c2c(S(=O)(=O)N1)cccc2)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 C26H22N4O4S MW 486.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N4O4S/c1-17-22(26(32)30(29(17)2)19-13-7-4-8-14-19)27-23-20-15-9-10-16-21(20)35(33,34)28-24(23)25(31)18-11-5-3-6-12-18/h3-16,27-28H,1-2H3InChIKey
ROAOPYGOYBCASE-UHFFFAOYSA-NSynonyms
4((11DIOXIDO3(PHENYLCARBONYL)2H12BENZOTHIAZIN4YL)AMINO)15DIMETHYL2PHENYL12DIHYDRO3HPYRAZOL3ONE
4((3benzoyl11dioxido2Hbenzo(e)(12)thiazin4yl)amino)15dimethyl2phenyl1Hpyrazol3(2H)one
4((3BENZOYL11DIOXO2H1
4((3benzoyl11dioxo2H1$l^(6)2benzothiazin4yl)amino)15dimethyl2phenylpyrazol3one
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=C(NS(=O)(=O)C4=CC=CC=C43)C(=O)C5=CC=CC=C5
InChI=1SC26H22N4O4Sc11722(26(32)30(29(17)2)19137481419)272320159101621(20)35(3334)2824(23)25(31)18115361218h3162728H12H3
MFCD02240556
O=C(C1=C(Nc2c(=O)n(n(c2C)C)c2ccccc2)c2c(S(=O)(=O)N1)cccc2)c1ccccc1
STK014167
ZINC000008985808
ZINC08985808
ZINC8985808
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