Vitas-M small molecule compound
3-[1-{[(3-chloro-1-benzothiophen-2-yl)carbonyl]amino}-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid
Catalog ID
STK278353
SMILES OC(=O)CCc1ccc(n1NC(=O)c1sc2c(c1Cl)cccc2)c1ccc(cc1)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 C22H16ClFN2O3S MW 442.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClFN2O3S/c23-20-16-3-1-2-4-18(16)30-21(20)22(29)25-26-15(10-12-19(27)28)9-11-17(26)13-5-7-14(24)8-6-13/h1-9,11H,10,12H2,(H,25,29)(H,27,28)InChIKey
WTMARJRNPIIQLC-UHFFFAOYSA-NSynonyms
3(1(((3chloro1benzothiophen2yl)carbonyl)amino)5(4fluorophenyl)1Hpyrrol2yl)propanoicacid
3(1((3CHLORO1BENZOTHIOPHENE2CARBONYL)AMINO)5(4FLUOROPHENYL)PYRROL2YL)PROPANOICACID
C1=CC=C2C(=C1)C(=C(S2)C(=O)NN3C(=CC=C3C4=CC=C(C=C4)F)CCC(=O)O)Cl
InChI=1SC22H16ClFN2O3Sc232016312418(16)3021(20)22(29)252615(101219(27)28)91117(26)135714(24)8613h1911H1012H2(H2529)(H2728)
MFCD03696632
ZINC000000980327
ZINC980327
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