Vitas-M small molecule compound
8-[4-(benzyloxy)-3-methoxyphenyl]-3-(2-methylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK886978
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(c(c1)OC)OCc1ccccc1)c1ccccc1C
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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 C29H27N3O3S MW 497.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N3O3S/c1-20-8-6-7-11-25(20)31-18-32-28(33)15-23(24(16-30)29(32)36-19-31)22-12-13-26(27(14-22)34-2)35-17-21-9-4-3-5-10-21/h3-14,23H,15,17-19H2,1-2H3InChIKey
FRRTYRALMKEJMH-UHFFFAOYSA-NSynonyms
8(3methoxy4phenylmethoxyphenyl)3(2methylphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(4(benzyloxy)3methoxyphenyl)3(2methylphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CC1=CC=CC=C1N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC(=C(C=C4)OCC5=CC=CC=C5)OC
InChI=1SC29H27N3O3Sc1208671125(20)31183228(33)1523(24(1630)29(32)361931)22121326(27(1422)342)35172194351021h31423H151719H212H3
MFCD10087686
ZINC000009693549
ZINC000009693550
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