Vitas-M small molecule compound

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

Catalog ID
STK850785
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)OC)c1cccc(c1)Cl

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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 C21H18ClN3O2S MW 411.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O2S/c1-27-17-7-5-14(6-8-17)18-10-20(26)25-12-24(13-28-21(25)19(18)11-23)16-4-2-3-15(22)9-16/h2-9,18H,10,12-13H2,1H3
InChIKey
QPWQUGRTTGLTQP-UHFFFAOYSA-N
Synonyms
896091-77-3
3(3chlorophenyl)8(4methoxyphenyl)6oxo234678hexahydropyrido(21b)(135)thiadiazine9carbonitrile
3(3chlorophenyl)8(4methoxyphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
3(3chlorophenyl)8(4methoxyphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
896091773
COC1=CC=C(C=C1)C2CC(=O)N3CN(CSC3=C2C#N)C4=CC(=CC=C4)Cl
InChI=1SC21H18ClN3O2Sc127177514(6817)181020(26)251224(132821(25)19(18)1123)1642315(22)916h2918H101213H21H3
MFCD06598923
ZINC000002216275
ZINC000002216277

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Available files

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