Vitas-M small molecule compound
3',9'-bis(furan-2-ylmethyl)-6'-thioxo-3',4',9',10'-tetrahydro-2'H-spiro[cyclohexane-1,12'-[1,3,5,9]tetraaza[7,11]methano[1,3,5]triazino[1,2-a][1,5]diazocine]-7',11'(6'H,8'H)-dicarbonitrile
Catalog ID
STK827055
SMILES N#CC12CN(Cc3ccco3)CC(C32CCCCC3)(C2=NCN(CN2C1=S)Cc1ccco1)C#N
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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 C26H28N6O2S MW 488.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N6O2S/c27-14-24-16-30(12-20-6-4-10-33-20)17-25(15-28,26(24)8-2-1-3-9-26)23(35)32-19-31(18-29-22(24)32)13-21-7-5-11-34-21/h4-7,10-11H,1-3,8-9,12-13,16-19H2InChIKey
FXOMJIREFPWKNI-UHFFFAOYSA-NSynonyms
39bis(furan2ylmethyl)6thioxo34910tetrahydro2Hspiro(cyclohexane112(1359)tetraaza(711)methano(135)triazino(12a)(15)diazocine)711(6H8H)dicarbonitrile
C1CCC2(CC1)C3(CN(CC2(C(=S)N4C3=NCN(C4)CC5=CC=CO5)C#N)CC6=CC=CO6)C#N
InChI=1SC26H28N6O2Sc2714241630(122064103320)1725(152826(24)8213926)23(35)321931(182922(24)32)132175113421h471011H138912131619H2
MFCD10087164
ZINC000019331024
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