Vitas-M small molecule compound
8-(3-bromo-5-ethoxy-4-hydroxyphenyl)-3-(4-ethoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK886943
SMILES CCOc1ccc(cc1)N1CSC2=C(C#N)C(CC(=O)N2C1)c1cc(Br)c(c(c1)OCC)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 C24H24BrN3O4S MW 530.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24BrN3O4S/c1-3-31-17-7-5-16(6-8-17)27-13-28-22(29)11-18(19(12-26)24(28)33-14-27)15-9-20(25)23(30)21(10-15)32-4-2/h5-10,18,30H,3-4,11,13-14H2,1-2H3InChIKey
PEIGCQLOOWPMNQ-UHFFFAOYSA-NSynonyms
8(3bromo5ethoxy4hydroxyphenyl)3(4ethoxyphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(3bromo5ethoxy4hydroxyphenyl)3(4ethoxyphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CCOC1=CC=C(C=C1)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC(=C(C(=C4)Br)O)OCC
InChI=1SC24H24BrN3O4Sc1331177516(6817)27132822(29)1118(19(1226)24(28)331427)15920(25)23(30)21(1015)3242h5101830H34111314H212H3
MFCD10087625
ZINC000098048417
ZINC000098048418
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