Vitas-M small molecule compound
2-methylpropyl 4-({4-[2-(4-{[(4-methylphenyl)sulfonyl]oxy}phenyl)-2-oxoethoxy]-4-oxobutanoyl}amino)benzoate
Catalog ID
STK290139
SMILES CC(COC(=O)c1ccc(cc1)NC(=O)CCC(=O)OCC(=O)c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)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 C30H31NO9S MW 581.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31NO9S/c1-20(2)18-39-30(35)23-6-10-24(11-7-23)31-28(33)16-17-29(34)38-19-27(32)22-8-12-25(13-9-22)40-41(36,37)26-14-4-21(3)5-15-26/h4-15,20H,16-19H2,1-3H3,(H,31,33)InChIKey
XVAFTQIIXOBSGW-UHFFFAOYSA-NSynonyms
2(4((4METHYLPHENYL)SULFONYLOXY)PHENYL)2OXOETHYL3(N(4((2METHYLPROPYL)OXYCARBONYL)PHENYL)CARBAMOYL)PROPANOATE
2methylpropyl4((4(2(4(((4methylphenyl)sulfonyl)oxy)phenyl)2oxoethoxy)4oxobutanoyl)amino)benzoate
2METHYLPROPYL4((4(2(4(4METHYLPHENYL)SULFONYLOXYPHENYL)2OXOETHOXY)4OXOBUTANOYL)AMINO)BENZOATE
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C(=O)COC(=O)CCC(=O)NC3=CC=C(C=C3)C(=O)OCC(C)C
InChI=1SC30H31NO9Sc120(2)183930(35)2361024(11723)3128(33)161729(34)381927(32)2281225(13922)4041(3637)2614421(3)51526h41520H1619H213H3(H3133)
MFCD06136421
ZINC000102094317
ZINC102094317
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