Vitas-M small molecule compound
3-(2-ethylphenyl)-6-oxo-8-[4-(propan-2-yl)phenyl]-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK827404
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)C(C)C)c1ccccc1CC
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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 C25H27N3OS MW 417.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3OS/c1-4-18-7-5-6-8-23(18)27-15-28-24(29)13-21(22(14-26)25(28)30-16-27)20-11-9-19(10-12-20)17(2)3/h5-12,17,21H,4,13,15-16H2,1-3H3InChIKey
UBLIGZXKOZDGGZ-UHFFFAOYSA-NSynonyms
3(2ethylphenyl)6oxo8(4(propan2yl)phenyl)3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
3(2ethylphenyl)6oxo8(4propan2ylphenyl)2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
CCC1=CC=CC=C1N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC=C(C=C4)C(C)C
InChI=1SC25H27N3OSc1418756823(18)27152824(29)1321(22(1426)25(28)301627)2011919(101220)17(2)3h5121721H4131516H213H3
MFCD10087770
ZINC000004923384
ZINC000004923390
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