Vitas-M small molecule compound
8-(4-ethoxy-3-methoxyphenyl)-6-oxo-3-phenyl-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK887065
SMILES CCOc1ccc(cc1OC)C1CC(=O)N2C(=C1C#N)SCN(C2)c1ccccc1
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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 C23H23N3O3S MW 421.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O3S/c1-3-29-20-10-9-16(11-21(20)28-2)18-12-22(27)26-14-25(17-7-5-4-6-8-17)15-30-23(26)19(18)13-24/h4-11,18H,3,12,14-15H2,1-2H3InChIKey
XFYOSBAVHDZATN-UHFFFAOYSA-NSynonyms
8(4ethoxy3methoxyphenyl)6oxo3phenyl2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(4ethoxy3methoxyphenyl)6oxo3phenyl3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CCOC1=C(C=C(C=C1)C2CC(=O)N3CN(CSC3=C2C#N)C4=CC=CC=C4)OC
InChI=1SC23H23N3O3Sc13292010916(1121(20)282)181222(27)261425(177546817)153023(26)19(18)1324h41118H3121415H212H3
MFCD10087813
ZINC000004923024
ZINC000004923027
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