Vitas-M small molecule compound

(4aR,7aS)-1-(4-chlorophenyl)-4-cycloheptylhexahydrothieno[3,4-b]pyrazin-2(1H)-one 6,6-dioxide

Catalog ID
STK634779
SMILES Clc1ccc(cc1)N1C(=O)CN([C@@H]2[C@H]1CS(=O)(=O)C2)C1CCCCCC1

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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 C19H25ClN2O3S MW 396.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25ClN2O3S/c20-14-7-9-16(10-8-14)22-18-13-26(24,25)12-17(18)21(11-19(22)23)15-5-3-1-2-4-6-15/h7-10,15,17-18H,1-6,11-13H2/t17-,18+/m0/s1
InChIKey
BPOFXNSTTMAIFW-ZWKOTPCHSA-N
Synonyms
1212472-50-8
(4aR7aS)1(4chlorophenyl)4cycloheptylhexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aS7aR)4(4chlorophenyl)1cycloheptyl66dioxo4a577atetrahydro2Hthieno(34b)pyrazin3one
1212472508
C1CCCC(CC1)N2CC(=O)N(C3C2CS(=O)(=O)C3)C4=CC=C(C=C4)Cl
Clc1ccc(cc1)N1C(=O)CN((C@@H)2(C@H)1CS(=O)(=O)C2)C1CCCCCC1
InChI=1SC19H25ClN2O3Sc20147916(10814)22181326(2425)1217(18)21(1119(22)23)1553124615h710151718H161113H2t1718+m0s1
MFCD18246592
ZINC000055408558
ZINC55408558

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Available files

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