Vitas-M small molecule compound
3-benzyl-6-chloro-4-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-beta-alaninate
Catalog ID
STL226633
SMILES O=C(Oc1cc2oc(=O)c(c(c2cc1Cl)C)Cc1ccccc1)CCNS(=O)(=O)c1ccc(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 C27H24ClNO6S MW 526.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24ClNO6S/c1-17-8-10-20(11-9-17)36(32,33)29-13-12-26(30)34-25-16-24-21(15-23(25)28)18(2)22(27(31)35-24)14-19-6-4-3-5-7-19/h3-11,15-16,29H,12-14H2,1-2H3InChIKey
ZAAZZHLGGNWNAB-UHFFFAOYSA-NSynonyms
842976-91-4(3BENZYL6CHLORO4METHYL2OXOCHROMEN7YL)3((4METHYLPHENYL)SULFONYLAMINO)PROPANOATE
3benzyl6chloro4methyl2oxo2Hchromen7yl3(4methylphenylsulfonamido)propanoate
3benzyl6chloro4methyl2oxo2Hchromen7ylN((4methylphenyl)sulfonyl)betaalaninate
842976914
CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OC2=C(C=C3C(=C(C(=O)OC3=C2)CC4=CC=CC=C4)C)Cl
InChI=1SC27H24ClNO6Sc11781020(11917)36(3233)29131226(30)3425162421(1523(25)28)18(2)22(27(31)3524)14196435719h311151629H1214H212H3
MFCD04013034
ZINC000002415009
ZINC2415009
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