Vitas-M small molecule compound
8-[4-(benzyloxy)phenyl]-3-(4-methoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK886977
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)OCc1ccccc1)c1ccc(cc1)OC
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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 C28H25N3O3S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O3S/c1-33-23-13-9-22(10-14-23)30-18-31-27(32)15-25(26(16-29)28(31)35-19-30)21-7-11-24(12-8-21)34-17-20-5-3-2-4-6-20/h2-14,25H,15,17-19H2,1H3InChIKey
RJSFSAQALVTIJK-UHFFFAOYSA-NSynonyms
3(4methoxyphenyl)6oxo8(4phenylmethoxyphenyl)2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(4(benzyloxy)phenyl)3(4methoxyphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
COC1=CC=C(C=C1)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC=C(C=C4)OCC5=CC=CC=C5
InChI=1SC28H25N3O3Sc1332313922(101423)30183127(32)1525(26(1629)28(31)351930)2171124(12821)3417205324620h21425H151719H21H3
MFCD10087684
ZINC000009693547
ZINC000009693548
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