Vitas-M small molecule compound
4,6-dimethyl-2-{[(4-methyl-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]sulfanyl}pyrimidine
Catalog ID
STL079633
SMILES Cc1cc(C)nc(n1)SCc1nnc(n1C)SC/C=C/c1ccccc1
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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 C19H21N5S2 MW 383.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N5S2/c1-14-12-15(2)21-18(20-14)26-13-17-22-23-19(24(17)3)25-11-7-10-16-8-5-4-6-9-16/h4-10,12H,11,13H2,1-3H3/b10-7+InChIKey
MNAKNISSTBHGQU-JXMROGBWSA-NSynonyms
638137-10-72((5((2E)3PHENYLPROP2ENYLTHIO)4METHYL(124TRIAZOL3YL))METHYLTHIO)46DIMETHYLPYRIMIDINE
46dimethyl2(((4methyl5(((2E)3phenylprop2en1yl)sulfanyl)4H124triazol3yl)methyl)sulfanyl)pyrimidine
46DIMETHYL2((4METHYL5((E)3PHENYLPROP2ENYL)SULFANYL124TRIAZOL3YL)METHYLSULFANYL)PYRIMIDINE
638137107
CC1=CC(=NC(=N1)SCC2=NN=C(N2C)SCC=CC3=CC=CC=C3)C
Cc1cc(C)nc(n1)SCc1nnc(n1C)SCC=Cc1ccccc1
InChI=1SC19H21N5S2c1141215(2)2118(2014)261317222319(24(17)3)2511710168546916h41012H1113H213H3b107+
MFCD04444035
ZINC000002668809
ZINC02668809
ZINC2668809
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