Vitas-M small molecule compound
3-(3,4-dimethylphenyl)-6-oxo-8-(3,4,5-trimethoxyphenyl)-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK852414
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1cc(OC)c(c(c1)OC)OC)c1ccc(c(c1)C)C
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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 C25H27N3O4S MW 465.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O4S/c1-15-6-7-18(8-16(15)2)27-13-28-23(29)11-19(20(12-26)25(28)33-14-27)17-9-21(30-3)24(32-5)22(10-17)31-4/h6-10,19H,11,13-14H2,1-5H3InChIKey
DKQLTMORGUTOKT-UHFFFAOYSA-NSynonyms
896090-73-63(34dimethylphenyl)6oxo8(345trimethoxyphenyl)234678hexahydropyrido(21b)(135)thiadiazine9carbonitrile
3(34dimethylphenyl)6oxo8(345trimethoxyphenyl)2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
3(34dimethylphenyl)6oxo8(345trimethoxyphenyl)3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
896090736
CC1=C(C=C(C=C1)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC(=C(C(=C4)OC)OC)OC)C
InChI=1SC25H27N3O4Sc1156718(816(15)2)27132823(29)1119(20(1226)25(28)331427)17921(303)24(325)22(1017)314h61019H111314H215H3
MFCD06593397
ZINC000002442419
ZINC000002442421
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