Vitas-M small molecule compound
ethyl 2-[({[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK302873
SMILES CCOC(=O)c1c(NC(=O)CSc2nnc(n2c2ccccc2OC)c2cc(n(n2)C)C)sc(c1C)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 C25H28N6O4S2 MW 540.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N6O4S2/c1-7-35-24(33)21-15(3)16(4)37-23(21)26-20(32)13-36-25-28-27-22(17-12-14(2)30(5)29-17)31(25)18-10-8-9-11-19(18)34-6/h8-12H,7,13H2,1-6H3,(H,26,32)InChIKey
RJOXGKJJDQMUSN-UHFFFAOYSA-NSynonyms
1005695-39-51005695395
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3OC)C4=NN(C(=C4)C)C
ethyl2((((5(15dimethyl1Hpyrazol3yl)4(2methoxyphenyl)4H124triazol3yl)sulfanyl)acetyl)amino)45dimethylthiophene3carboxylate
ETHYL2((2((5(15DIMETHYLPYRAZOL3YL)4(2METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
InChI=1SC25H28N6O4S2c173524(33)2115(3)16(4)3723(21)2620(32)133625282722(171214(2)30(5)2917)31(25)1810891119(18)346h812H713H216H3(H2632)
MFCD04048981
ZINC000002747803
ZINC2747803
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