Vitas-M small molecule compound
2-({1-[2-(3,4-dimethoxyphenyl)ethyl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid
Catalog ID
STL019653
SMILES COc1ccc(cc1OC)CCN1C(=O)CC(C1=O)Sc1ccccc1C(=O)O
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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 C21H21NO6S MW 415.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO6S/c1-27-15-8-7-13(11-16(15)28-2)9-10-22-19(23)12-18(20(22)24)29-17-6-4-3-5-14(17)21(25)26/h3-8,11,18H,9-10,12H2,1-2H3,(H,25,26)InChIKey
OZZAPKBGNBWNSO-UHFFFAOYSA-NSynonyms
526190-70-52((1(2(34dimethoxyphenyl)ethyl)25dioxopyrrolidin3yl)sulfanyl)benzoicacid
2((1(34DIMETHOXYPHENETHYL)25DIOXOPYRROLIDIN3YL)THIO)BENZOICACID
2(1(2(34DIMETHOXYPHENYL)ETHYL)25DIOXOAZOLIDIN3YLTHIO)BENZOICACID
2(1(2(34DIMETHOXYPHENYL)ETHYL)25DIOXOPYRROLIDIN3YL)SULFANYLBENZOICACID
526190705
COC1=C(C=C(C=C1)CCN2C(=O)CC(C2=O)SC3=CC=CC=C3C(=O)O)OC
InChI=1SC21H21NO6Sc127158713(1116(15)282)9102219(23)1218(20(22)24)2917643514(17)21(25)26h381118H91012H212H3(H2526)
MFCD03545004
ZINC000000799945
ZINC000019878562
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