Vitas-M small molecule compound
8-[4-(benzyloxy)-3-methoxyphenyl]-6-oxo-3-phenyl-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK827345
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(c(c1)OC)OCc1ccccc1)c1ccccc1
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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/c1-33-26-14-21(12-13-25(26)34-17-20-8-4-2-5-9-20)23-15-27(32)31-18-30(22-10-6-3-7-11-22)19-35-28(31)24(23)16-29/h2-14,23H,15,17-19H2,1H3InChIKey
QLSGJUQLIGCBCG-UHFFFAOYSA-NSynonyms
8(3methoxy4phenylmethoxyphenyl)6oxo3phenyl2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(4(benzyloxy)3methoxyphenyl)6oxo3phenyl3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
COC1=C(C=CC(=C1)C2CC(=O)N3CN(CSC3=C2C#N)C4=CC=CC=C4)OCC5=CC=CC=C5
InChI=1SC28H25N3O3Sc133261421(121325(26)3417208425920)231527(32)311830(22106371122)193528(31)24(23)1629h21423H151719H21H3
MFCD10087660
ZINC000009693529
ZINC000009693530
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