Vitas-M small molecule compound
8-[4-(benzyloxy)-3-methoxyphenyl]-3-(3,4-dimethylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK827346
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(c(c1)OC)OCc1ccccc1)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 C30H29N3O3S MW 511.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O3S/c1-20-9-11-24(13-21(20)2)32-18-33-29(34)15-25(26(16-31)30(33)37-19-32)23-10-12-27(28(14-23)35-3)36-17-22-7-5-4-6-8-22/h4-14,25H,15,17-19H2,1-3H3InChIKey
OQPCOXMGSBQKBQ-UHFFFAOYSA-NSynonyms
3(34dimethylphenyl)8(3methoxy4phenylmethoxyphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(4(benzyloxy)3methoxyphenyl)3(34dimethylphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CC1=C(C=C(C=C1)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC(=C(C=C4)OCC5=CC=CC=C5)OC)C
InChI=1SC30H29N3O3Sc12091124(1321(20)2)32183329(34)1525(26(1631)30(33)371932)23101227(28(1423)353)3617227546822h41425H151719H213H3
MFCD10087662
ZINC000012251038
ZINC000012251039
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