Vitas-M small molecule compound
8-(4-ethoxy-3-methoxyphenyl)-3-(4-ethylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK827439
SMILES CCOc1ccc(cc1OC)C1CC(=O)N2C(=C1C#N)SCN(C2)c1ccc(cc1)CC
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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 C25H27N3O3S MW 449.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O3S/c1-4-17-6-9-19(10-7-17)27-15-28-24(29)13-20(21(14-26)25(28)32-16-27)18-8-11-22(31-5-2)23(12-18)30-3/h6-12,20H,4-5,13,15-16H2,1-3H3InChIKey
XSESQUNAKIICJB-UHFFFAOYSA-NSynonyms
8(4ethoxy3methoxyphenyl)3(4ethylphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(4ethoxy3methoxyphenyl)3(4ethylphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CCC1=CC=C(C=C1)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC(=C(C=C4)OCC)OC
InChI=1SC25H27N3O3Sc14176919(10717)27152824(29)1320(21(1426)25(28)321627)1881122(3152)23(1218)303h61220H45131516H213H3
MFCD10087835
ZINC000009693259
ZINC000009693260
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