Vitas-M small molecule compound

2-{2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxoethyl}-1,2-benzothiazol-3(2H)-one 1,1-dioxide

Catalog ID
STK134482
SMILES O=C(N1CCN(CC1)C(c1ccccc1)c1ccccc1)CN1C(=O)c2c(S1(=O)=O)cccc2

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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 C26H25N3O4S MW 475.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O4S/c30-24(19-29-26(31)22-13-7-8-14-23(22)34(29,32)33)27-15-17-28(18-16-27)25(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-14,25H,15-19H2
InChIKey
JMXNIYNGUUQLGT-UHFFFAOYSA-N
Synonyms
586991-85-7
2(2(4(DIPHENYLMETHYL)PIPERAZIN1YL)2OXOETHYL)12BENZOTHIAZOL3(2H)ONE11DIOXIDE
2(2(4BENZHYDRYL1PIPERAZINYL)2OXOETHYL)12BENZISOTHIAZOL3(2H)ONE11DIOXIDE
2(2(4BENZHYDRYLPIPERAZIN1YL)2OXOETHYL)11DIOXO12BENZOTHIAZOL3ONE
2(2(4BENZHYDRYLPIPERAZIN1YL)2OXOETHYL)BENZO(D)ISOTHIAZOL3(2H)ONE11DIOXIDE
586991857
C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CN4C(=O)C5=CC=CC=C5S4(=O)=O
InChI=1SC26H25N3O4Sc3024(192926(31)2213781423(22)34(2932)33)27151728(181627)25(2093141020)21115261221h11425H1519H2
MFCD03270448
ZINC000019831862
ZINC19831862

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Available files

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