Vitas-M small molecule compound
1,1'-[6-(3,4-dimethoxyphenyl)-3-methyl-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]dipropan-1-one
Catalog ID
STK686650
SMILES CCC(=O)c1sc2nnc(n2n(c1c1ccc(c(c1)OC)OC)C(=O)CC)C
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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 C19H22N4O4S MW 402.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N4O4S/c1-6-13(24)18-17(12-8-9-14(26-4)15(10-12)27-5)23(16(25)7-2)22-11(3)20-21-19(22)28-18/h8-10H,6-7H2,1-5H3InChIKey
CDRTXQFIBGJDGT-UHFFFAOYSA-NSynonyms
1(6(34DIMETHOXYPHENYL)3METHYL5PROPANOYL(124)TRIAZOLO(34B)(134)THIADIAZIN7YL)PROPAN1ONE
11(6(34dimethoxyphenyl)3methyl5H(124)triazolo(34b)(134)thiadiazine57diyl)dipropan1one
CCC(=O)C1=C(N(N2C(=NN=C2S1)C)C(=O)CC)C3=CC(=C(C=C3)OC)OC
InChI=1SC19H22N4O4Sc1613(24)1817(128914(264)15(1012)275)23(16(25)72)2211(3)202119(22)2818h810H67H215H3
MFCD06016693
ZINC000004727562
ZINC04727562
ZINC4727562
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