Vitas-M small molecule compound
4-[({5-chloro-2-[(4-methylbenzyl)sulfanyl]pyrimidin-4-yl}carbonyl)amino]butanoic acid
Catalog ID
STL217761
SMILES OC(=O)CCCNC(=O)c1nc(ncc1Cl)SCc1ccc(cc1)C
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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 C17H18ClN3O3S MW 379.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18ClN3O3S/c1-11-4-6-12(7-5-11)10-25-17-20-9-13(18)15(21-17)16(24)19-8-2-3-14(22)23/h4-7,9H,2-3,8,10H2,1H3,(H,19,24)(H,22,23)InChIKey
ZGVGRZNLGKIJEP-UHFFFAOYSA-NSynonyms
4(((5chloro2((4methylbenzyl)sulfanyl)pyrimidin4yl)carbonyl)amino)butanoicacid
4((5chloro2((4methylphenyl)methylsulfanyl)pyrimidine4carbonyl)amino)butanoicacid
4((5CHLORO2((4METHYLPHENYL)METHYLTHIO)PYRIMIDIN4YL)CARBONYLAMINO)BUTANOICACID
CC1=CC=C(C=C1)CSC2=NC=C(C(=N2)C(=O)NCCCC(=O)O)Cl
InChI=1SC17H18ClN3O3Sc1114612(7511)10251720913(18)15(2117)16(24)1982314(22)23h479H23810H21H3(H1924)(H2223)
MFCD18080979
ZINC000041154681
ZINC41154681
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