Vitas-M small molecule compound
{[2-({4-[(6-fluoro-2-methyl-3,4-dihydroquinolin-1(2H)-yl)sulfonyl]phenyl}amino)-2-oxoethyl]sulfanyl}acetic acid
Catalog ID
STK470057
SMILES OC(=O)CSCC(=O)Nc1ccc(cc1)S(=O)(=O)N1C(C)CCc2c1ccc(c2)F
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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 C20H21FN2O5S2 MW 452.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21FN2O5S2/c1-13-2-3-14-10-15(21)4-9-18(14)23(13)30(27,28)17-7-5-16(6-8-17)22-19(24)11-29-12-20(25)26/h4-10,13H,2-3,11-12H2,1H3,(H,22,24)(H,25,26)InChIKey
QSTUMFNQDWRLQS-UHFFFAOYSA-NSynonyms
((2((4((6fluoro2methyl34dihydroquinolin1(2H)yl)sulfonyl)phenyl)amino)2oxoethyl)sulfanyl)aceticacid
2(2(4((6fluoro2methyl34dihydro2Hquinolin1yl)sulfonyl)anilino)2oxoethyl)sulfanylaceticacid
CC1CCC2=C(N1S(=O)(=O)C3=CC=C(C=C3)NC(=O)CSCC(=O)O)C=CC(=C2)F
InChI=1SC20H21FN2O5S2c11323141015(21)4918(14)23(13)30(2728)177516(6817)2219(24)11291220(25)26h41013H231112H21H3(H2224)(H2526)
MFCD06084574
ZINC000020572246
ZINC000020572247
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