Vitas-M small molecule compound

3-(4-butylphenyl)-8-(3-methoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile

Catalog ID
STK886989
SMILES CCCCc1ccc(cc1)N1CSC2=C(C#N)C(CC(=O)N2C1)c1cccc(c1)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 C25H27N3O2S MW 433.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O2S/c1-3-4-6-18-9-11-20(12-10-18)27-16-28-24(29)14-22(23(15-26)25(28)31-17-27)19-7-5-8-21(13-19)30-2/h5,7-13,22H,3-4,6,14,16-17H2,1-2H3
InChIKey
GLNUQLVUVZNFER-UHFFFAOYSA-N
Synonyms

3(4butylphenyl)8(3methoxyphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
3(4butylphenyl)8(3methoxyphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CCCCC1=CC=C(C=C1)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC(=CC=C4)OC
InChI=1SC25H27N3O2Sc13461891120(121018)27162824(29)1422(23(1526)25(28)311727)1975821(1319)302h571322H346141617H212H3
MFCD10087707
ZINC000009693577
ZINC000009693578

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Available files

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