Vitas-M small molecule compound
(2Z)-2-[(1R,2R,5S)-2-{4-methyl-3-[(9-oxoacridin-10(9H)-yl)methyl]-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl}-6,8-dioxabicyclo[3.2.1]oct-4-ylidene]hydrazinecarbothioamide (non-preferred name)
Catalog ID
STK781005
SMILES NC(=S)N/N=C\1/C[C@H]([C@H]2O[C@@H]1OC2)n1nc(n(c1=S)C)Cn1c2ccccc2c(=O)c2c1cccc2
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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 C24H23N7O3S2 MW 521.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N7O3S2/c1-29-20(11-30-16-8-4-2-6-13(16)21(32)14-7-3-5-9-17(14)30)28-31(24(29)36)18-10-15(26-27-23(25)35)22-33-12-19(18)34-22/h2-9,18-19,22H,10-12H2,1H3,(H3,25,27,35)/b26-15-/t18-,19+,22+/m1/s1InChIKey
UAIBFOYGYOEOSD-NMFYCREYSA-NSynonyms
((Z)((1R2R5S)2(4methyl3((9oxoacridin10yl)methyl)5sulfanylidene124triazol1yl)68dioxabicyclo(321)octan4ylidene)amino)thiourea
(2Z)2((1R2R5S)2(4methyl3((9oxoacridin10(9H)yl)methyl)5thioxo45dihydro1H124triazol1yl)68dioxabicyclo(321)oct4ylidene)hydrazinecarbothioamide(nonpreferredname)
CN1C(=NN(C1=S)C2CC(=NNC(=S)N)C3OCC2O3)CN4C5=CC=CC=C5C(=O)C6=CC=CC=C64
InChI=1SC24H23N7O3S2c12920(113016842613(16)21(32)14735917(14)30)2831(24(29)36)181015(262723(25)35)22331219(18)3422h29181922H1012H21H3(H3252735)b2615t1819+22+m1s1
MFCD13372225
NC(=S)NN=C1C(C@H)((C@H)2O(C@@H)1OC2)n1nc(n(c1=S)C)Cn1c2ccccc2c(=O)c2c1cccc2
ZINC000020598166
ZINC102883393
Check stock
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