Vitas-M small molecule compound
ethyl 2-({[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK317649
SMILES CCOC(=O)c1c(NC(=S)NC(=O)c2c(Cl)cnn2CC)sc2c1CCCC2
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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 C18H21ClN4O3S2 MW 440.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21ClN4O3S2/c1-3-23-14(11(19)9-20-23)15(24)21-18(27)22-16-13(17(25)26-4-2)10-7-5-6-8-12(10)28-16/h9H,3-8H2,1-2H3,(H2,21,22,24,27)InChIKey
XUUCHGWVMVSWIF-UHFFFAOYSA-NSynonyms
494218-71-2494218712
CCN1C(=C(C=N1)Cl)C(=O)NC(=S)NC2=C(C3=C(S2)CCCC3)C(=O)OCC
ethyl2((((4chloro1ethyl1Hpyrazol5yl)carbonyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((4chloro2ethylpyrazole3carbonyl)carbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC18H21ClN4O3S2c132314(11(19)92023)15(24)2118(27)221613(17(25)2642)10756812(10)2816h9H38H212H3(H221222427)
MFCD02374274
ZINC000000649998
ZINC00649998
ZINC649998
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