Vitas-M small molecule compound
2-[(3-hydroxyphenyl)amino]-2-oxoethyl 4-{5-[(2-ethoxy-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}benzoate
Catalog ID
STK768361
SMILES CCOC(=O)CSc1nnnn1c1ccc(cc1)C(=O)OCC(=O)Nc1cccc(c1)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 C20H19N5O6S MW 457.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O6S/c1-2-30-18(28)12-32-20-22-23-24-25(20)15-8-6-13(7-9-15)19(29)31-11-17(27)21-14-4-3-5-16(26)10-14/h3-10,26H,2,11-12H2,1H3,(H,21,27)InChIKey
JCACUYUNGBCEHM-UHFFFAOYSA-NSynonyms
(2(3HYDROXYANILINO)2OXOETHYL)4(5(2ETHOXY2OXOETHYL)SULFANYLTETRAZOL1YL)BENZOATE
2((3hydroxyphenyl)amino)2oxoethyl4(5((2ethoxy2oxoethyl)sulfanyl)1Htetrazol1yl)benzoate
2(3HYDROXYANILINO)2OXOETHYL4(5((2ETHOXY2OXOETHYL)SULFANYL)1HTETRAAZOL1YL)BENZOATE
CCOC(=O)CSC1=NN=NN1C2=CC=C(C=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)O
InChI=1SC20H19N5O6Sc123018(28)12322022232425(20)158613(7915)19(29)311117(27)211443516(26)1014h31026H21112H21H3(H2127)
MFCD03133735
ZINC000002191425
ZINC02191425
ZINC2191425
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