Vitas-M small molecule compound

{4-chloro-3-[(5,5-dioxido-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-yl)amino]phenyl}(4-phenylpiperazin-1-yl)methanone

Catalog ID
STL135251
SMILES O=C(c1ccc(c(c1)NC1=NC2C(S1)CS(=O)(=O)C2)Cl)N1CCN(CC1)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 C22H23ClN4O3S2 MW 491.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN4O3S2/c23-17-7-6-15(12-18(17)24-22-25-19-13-32(29,30)14-20(19)31-22)21(28)27-10-8-26(9-11-27)16-4-2-1-3-5-16/h1-7,12,19-20H,8-11,13-14H2,(H,24,25)
InChIKey
DAGKVQFRDHNEHB-UHFFFAOYSA-N
Synonyms

(4CHLORO3(((3AR6AR)55DIOXIDO3A466ATETRAHYDROTHIENO(34D)(13)THIAZOL2YL)AMINO)PHENYL)(4PHENYLPIPERAZIN1YL)METHANONE
(4CHLORO3(((3AR6AS)55DIOXIDO3A466ATETRAHYDROTHIENO(34D)(13)THIAZOL2YL)AMINO)PHENYL)(4PHENYLPIPERAZIN1YL)METHANONE
(4chloro3((55dioxido3a466atetrahydrothieno(34d)(13)thiazol2yl)amino)phenyl)(4phenylpiperazin1yl)methanone
(4CHLORO3((55DIOXO3A466ATETRAHYDROTHIENO(34D)(13)THIAZOL2YL)AMINO)PHENYL)(4PHENYLPIPERAZIN1YL)METHANONE
C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)Cl)NC4=NC5CS(=O)(=O)CC5S4
InChI=1SC22H23ClN4O3S2c23177615(1218(17)242225191332(2930)1420(19)3122)21(28)2710826(91127)164213516h17121920H8111314H2(H2425)
MFCD05718003
ZINC000002688673
ZINC000009529941

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.