Vitas-M small molecule compound
8-(5-bromo-2-methoxyphenyl)-3-(4-ethoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK827364
SMILES CCOc1ccc(cc1)N1CSC2=C(C#N)C(CC(=O)N2C1)c1cc(Br)ccc1OC
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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 C23H22BrN3O3S MW 500.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrN3O3S/c1-3-30-17-7-5-16(6-8-17)26-13-27-22(28)11-18(20(12-25)23(27)31-14-26)19-10-15(24)4-9-21(19)29-2/h4-10,18H,3,11,13-14H2,1-2H3InChIKey
GFNVWUGMLWITBD-UHFFFAOYSA-NSynonyms
8(5bromo2methoxyphenyl)3(4ethoxyphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(5bromo2methoxyphenyl)3(4ethoxyphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CCOC1=CC=C(C=C1)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=C(C=CC(=C4)Br)OC
InChI=1SC23H22BrN3O3Sc1330177516(6817)26132722(28)1118(20(1225)23(27)311426)191015(24)4921(19)292h41018H3111314H212H3
MFCD10574659
ZINC000009693551
ZINC000009693552
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