Vitas-M small molecule compound
ethyl 4,5-dimethyl-2-[({[5-(1-methyl-1H-pyrazol-3-yl)-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]thiophene-3-carboxylate
Catalog ID
STK302848
SMILES CCOC(=O)c1c(NC(=O)CSc2nnc(n2CC2CCCO2)c2ccn(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 C22H28N6O4S2 MW 504.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N6O4S2/c1-5-31-21(30)18-13(2)14(3)34-20(18)23-17(29)12-33-22-25-24-19(16-8-9-27(4)26-16)28(22)11-15-7-6-10-32-15/h8-9,15H,5-7,10-12H2,1-4H3,(H,23,29)InChIKey
YTYLAERGCZDXSV-UHFFFAOYSA-NSynonyms
1005694-90-51005694905
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSC2=NN=C(N2CC3CCCO3)C4=NN(C=C4)C
ethyl45dimethyl2((((5(1methyl1Hpyrazol3yl)4(tetrahydrofuran2ylmethyl)4H124triazol3yl)sulfanyl)acetyl)amino)thiophene3carboxylate
ETHYL45DIMETHYL2((2((5(1METHYLPYRAZOL3YL)4(OXOLAN2YLMETHYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)THIOPHENE3CARBOXYLATE
InChI=1SC22H28N6O4S2c153121(30)1813(2)14(3)3420(18)2317(29)123322252419(168927(4)2616)28(22)111576103215h8915H571012H214H3(H2329)
MFCD04049052
ZINC000013958125
ZINC000013958128
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