Vitas-M small molecule compound

2-chloro-6-(3,4-dimethoxyphenyl)-7-(4-methoxyphenyl)-10-(methylsulfanyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine

Catalog ID
STL000440
SMILES COc1ccc(cc1)C1C2=C(Nc3n1nc(n3)SC)c1c(OC2c2ccc(c(c2)OC)OC)ccc(c1)Cl

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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 C28H25ClN4O4S MW 549.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25ClN4O4S/c1-34-18-9-5-15(6-10-18)25-23-24(30-27-31-28(38-4)32-33(25)27)19-14-17(29)8-12-20(19)37-26(23)16-7-11-21(35-2)22(13-16)36-3/h5-14,25-26H,1-4H3,(H,30,31,32)
InChIKey
MXRPSKAECQLCCC-UHFFFAOYSA-N
Synonyms
799831-01-9
2chloro6(34dimethoxyphenyl)7(4methoxyphenyl)10(methylsulfanyl)712dihydro6Hchromeno(43d)(124)triazolo(15a)pyrimidine
2chloro6(34dimethoxyphenyl)7(4methoxyphenyl)10(methylthio)712dihydro6Hchromeno(43d)(124)triazolo(15a)pyrimidine
799831019
COC1=CC=C(C=C1)C2C3=C(C4=C(C=CC(=C4)Cl)OC3C5=CC(=C(C=C5)OC)OC)N=C6N2NC(=N6)SC
InChI=1SC28H25ClN4O4Sc134189515(61018)252324(30273128(384)3233(25)27)191417(29)81220(19)3726(23)1671121(352)22(1316)363h5142526H14H3(H303132)
MFCD03684219
ZINC000002245803
ZINC000002245806

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Available files

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