Vitas-M small molecule compound
(5Z)-5-[5-(3,4-dimethoxyphenyl)pyrazolidin-3-ylidene]-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STK627922
SMILES COc1ccc(cc1OC)C1NN/C(=C\2/C(=O)N=C(N(C2=O)C)S)/C1
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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 C16H18N4O4S MW 362.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O4S/c1-20-15(22)13(14(21)17-16(20)25)10-7-9(18-19-10)8-4-5-11(23-2)12(6-8)24-3/h4-6,9,18-19H,7H2,1-3H3,(H,17,21,25)/b13-10-InChIKey
SSGZAZPYDNPIHO-RAXLEYEMSA-NSynonyms
(5Z)5(5(34dimethoxyphenyl)pyrazolidin3ylidene)1methyl2sulfanylidene13diazinane46dione
(5Z)5(5(34dimethoxyphenyl)pyrazolidin3ylidene)1methyl2sulfanylpyrimidine46(1H5H)dione
CN1C(=O)C(=C2CC(NN2)C3=CC(=C(C=C3)OC)OC)C(=O)NC1=S
COc1ccc(cc1OC)C1NNC(=C2C(=O)N=C(N(C2=O)C)S)C1
InChI=1SC16H18N4O4Sc12015(22)13(14(21)1716(20)25)1079(181910)84511(232)12(68)243h4691819H7H213H3(H172125)b1310
MFCD09794757
ZINC000009419529
ZINC000009419530
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