Vitas-M small molecule compound
(4-cyclohexylpiperazin-1-yl){4-[(5,5-dioxido-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-yl)amino]phenyl}methanone
Catalog ID
STL131471
SMILES O=C(c1ccc(cc1)NC1=NC2C(S1)CS(=O)(=O)C2)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 C22H30N4O3S2 MW 462.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N4O3S2/c27-21(26-12-10-25(11-13-26)18-4-2-1-3-5-18)16-6-8-17(9-7-16)23-22-24-19-14-31(28,29)15-20(19)30-22/h6-9,18-20H,1-5,10-15H2,(H,23,24)InChIKey
YMIGWVNCQSKKHU-UHFFFAOYSA-NSynonyms
(4cyclohexylpiperazin1yl)(4((55dioxido3a466atetrahydrothieno(34d)(13)thiazol2yl)amino)phenyl)methanone
(4CYCLOHEXYLPIPERAZIN1YL)(4((55DIOXO3A466ATETRAHYDROTHIENO(34D)(13)THIAZOL2YL)AMINO)PHENYL)METHANONE
C1CCC(CC1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)NC4=NC5CS(=O)(=O)CC5S4
InChI=1SC22H30N4O3S2c2721(26121025(111326)184213518)166817(9716)232224191431(2829)1520(19)3022h691820H151015H2(H2324)
MFCD15083799
ZINC000002958988
ZINC000009529905
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