Vitas-M small molecule compound

4-{[2-ethyl-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
STK021202
SMILES CCN1C(=C(Nc2c(=O)n(n(c2C)C)c2ccccc2)c2c(S1(=O)=O)cccc2)C(=O)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 C28H26N4O4S MW 514.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O4S/c1-4-31-26(27(33)20-13-7-5-8-14-20)25(22-17-11-12-18-23(22)37(31,35)36)29-24-19(2)30(3)32(28(24)34)21-15-9-6-10-16-21/h5-18,29H,4H2,1-3H3
InChIKey
NSCDFAIPHLXZER-UHFFFAOYSA-N
Synonyms
364595-17-5
364595175
4((2ETHYL11DIOXIDO3(PHENYLCARBONYL)2H12BENZOTHIAZIN4YL)AMINO)15DIMETHYL2PHENYL12DIHYDRO3HPYRAZOL3ONE
4((3BENZOYL2ETHYL11DIOXIDO2H12BENZOTHIAZIN4YL)AMINO)15DIMETHYL2PHENYL12DIHYDRO3HPYRAZOL3ONE
4((3benzoyl2ethyl11dioxido2Hbenzo(e)(12)thiazin4yl)amino)15dimethyl2phenyl1Hpyrazol3(2H)one
4((3BENZOYL2ETHYL11DIOXO1
4((3benzoyl2ethyl11dioxo1$l^(6)2benzothiazin4yl)amino)15dimethyl2phenylpyrazol3one
CCN1C(=C(C2=CC=CC=C2S1(=O)=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)C(=O)C5=CC=CC=C5
CCN1C(=C(Nc2c(=O)n(n(c2C)C)c2ccccc2)c2c(S1(=O)=O)cccc2)C(=O)c1ccccc1
InChI=1SC28H26N4O4Sc143126(27(33)20137581420)25(221711121823(22)37(3135)36)292419(2)30(3)32(28(24)34)211596101621h51829H4H213H3
MFCD02234030
STK021202
ZINC000000716104
ZINC00716104
ZINC716104

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Available files

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