Vitas-M small molecule compound

ethyl 3-[9-cyano-8-(3-methoxyphenyl)-6-oxo-7,8-dihydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazin-3(4H)-yl]benzoate

Catalog ID
STK886841
SMILES CCOC(=O)c1cccc(c1)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 C24H23N3O4S MW 449.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O4S/c1-3-31-24(29)17-7-4-8-18(10-17)26-14-27-22(28)12-20(21(13-25)23(27)32-15-26)16-6-5-9-19(11-16)30-2/h4-11,20H,3,12,14-15H2,1-2H3
InChIKey
QMKKNGGVFJNAIF-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC(=CC=C1)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC(=CC=C4)OC
ethyl3(9cyano8(3methoxyphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazin3yl)benzoate
ethyl3(9cyano8(3methoxyphenyl)6oxo78dihydro2H6Hpyrido(21b)(135)thiadiazin3(4H)yl)benzoate
InChI=1SC24H23N3O4Sc133124(29)1774818(1017)26142722(28)1220(21(1325)23(27)321526)1665919(1116)302h41120H3121415H212H3
MFCD10087443
ZINC000009408631
ZINC000009408632

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Available files

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