Vitas-M small molecule compound
3-(morpholin-4-ylcarbonothioyl)phenyl 3,4-dimethoxybenzoate
Catalog ID
STK009704
SMILES COc1cc(ccc1OC)C(=O)Oc1cccc(c1)C(=S)N1CCOCC1
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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 C20H21NO5S MW 387.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO5S/c1-23-17-7-6-15(13-18(17)24-2)20(22)26-16-5-3-4-14(12-16)19(27)21-8-10-25-11-9-21/h3-7,12-13H,8-11H2,1-2H3InChIKey
ZRFAEIYUJFQLQD-UHFFFAOYSA-NSynonyms
(3(MORPHOLINE4CARBOTHIOYL)PHENYL)34DIMETHOXYBENZOATE
3(MORPHOLIN4YLCARBONOTHIOYL)PHENYL34DIMETHOXYBENZOATE
COC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)C(=S)N3CCOCC3)OC
COc1cc(ccc1OC)C(=O)Oc1cccc(c1)C(=S)N1CCOCC1
InChI=1SC20H21NO5Sc123177615(1318(17)242)20(22)261653414(1216)19(27)218102511921h371213H811H212H3
MFCD02901251
STK009704
ZINC000004551057
ZINC04551057
ZINC4551057
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