Vitas-M small molecule compound
methyl 2-{[(6-fluoro-2-methyl-3,4-dihydroquinolin-1(2H)-yl)carbonothioyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK455618
SMILES COC(=O)c1c(NC(=S)N2C(C)CCc3c2ccc(c3)F)sc2c1CCC2
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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 C20H21FN2O2S2 MW 404.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21FN2O2S2/c1-11-6-7-12-10-13(21)8-9-15(12)23(11)20(26)22-18-17(19(24)25-2)14-4-3-5-16(14)27-18/h8-11H,3-7H2,1-2H3,(H,22,26)InChIKey
XZJNLKFJIIFWTP-UHFFFAOYSA-NSynonyms
CC1CCC2=C(N1C(=S)NC3=C(C4=C(S3)CCC4)C(=O)OC)C=CC(=C2)F
InChI=1SC20H21FN2O2S2c11167121013(21)8915(12)23(11)20(26)221817(19(24)252)1443516(14)2718h811H37H212H3(H2226)
METHYL2((((2R)6FLUORO2METHYL34DIHYDROQUINOLIN1(2H)YL)CARBOTHIOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
METHYL2((((2S)6FLUORO2METHYL34DIHYDROQUINOLIN1(2H)YL)CARBOTHIOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
methyl2(((6fluoro2methyl34dihydroquinolin1(2H)yl)carbonothioyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2((6FLUORO2METHYL34DIHYDRO2HQUINOLINE1CARBOTHIOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
MFCD04228563
ZINC000001119389
ZINC000001119390
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