Vitas-M small molecule compound
ethyl 4,5-dimethyl-2-{[({5-[(3-methyl-1H-pyrazol-1-yl)methyl]-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}thiophene-3-carboxylate
Catalog ID
STK305065
SMILES CCOC(=O)c1c(NC(=O)CSc2nnc(n2CC2CCCO2)Cn2ccc(n2)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 C23H30N6O4S2 MW 518.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N6O4S2/c1-5-32-22(31)20-15(3)16(4)35-21(20)24-19(30)13-34-23-26-25-18(12-28-9-8-14(2)27-28)29(23)11-17-7-6-10-33-17/h8-9,17H,5-7,10-13H2,1-4H3,(H,24,30)InChIKey
VFMXMLBYDNYUKP-UHFFFAOYSA-NSynonyms
1005604-84-11005604841
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSC2=NN=C(N2CC3CCCO3)CN4C=CC(=N4)C
ethyl45dimethyl2((((5((3methyl1Hpyrazol1yl)methyl)4(tetrahydrofuran2ylmethyl)4H124triazol3yl)sulfanyl)acetyl)amino)thiophene3carboxylate
ETHYL45DIMETHYL2((2((5((3METHYLPYRAZOL1YL)METHYL)4(OXOLAN2YLMETHYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)THIOPHENE3CARBOXYLATE
InChI=1SC23H30N6O4S2c153222(31)2015(3)16(4)3521(20)2419(30)133423262518(12289814(2)2728)29(23)111776103317h8917H571013H214H3(H2430)
MFCD04049352
ZINC000013959430
ZINC000013959431
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