Vitas-M small molecule compound
methyl 2-({[5-chloro-2-(propylsulfanyl)pyrimidin-4-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK882663
SMILES CCCSc1ncc(c(n1)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2)Cl
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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 C18H20ClN3O3S2 MW 425.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClN3O3S2/c1-3-8-26-18-20-9-11(19)14(21-18)15(23)22-16-13(17(24)25-2)10-6-4-5-7-12(10)27-16/h9H,3-8H2,1-2H3,(H,22,23)InChIKey
FXVXYOXLGFPJTE-UHFFFAOYSA-NSynonyms
CCCSC1=NC=C(C(=N1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC)Cl
InChI=1SC18H20ClN3O3S2c138261820911(19)14(2118)15(23)221613(17(24)252)10645712(10)2716h9H38H212H3(H2223)
methyl2(((5chloro2(propylsulfanyl)pyrimidin4yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((5chloro2propylsulfanylpyrimidine4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD06646325
ZINC000008612092
ZINC08612092
ZINC8612092
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