Vitas-M small molecule compound
2-{[3-(4-methoxyphenyl)-6,6-dimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Catalog ID
STK551500
SMILES COc1ccc(cc1)n1c(SCC(=O)NCCc2ccccc2)nc2c(c1=O)c1CC(C)(C)OCc1s2
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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 C28H29N3O4S2 MW 535.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O4S2/c1-28(2)15-21-22(16-35-28)37-25-24(21)26(33)31(19-9-11-20(34-3)12-10-19)27(30-25)36-17-23(32)29-14-13-18-7-5-4-6-8-18/h4-12H,13-17H2,1-3H3,(H,29,32)InChIKey
JBXCISLYVHUJCJ-UHFFFAOYSA-NSynonyms
799830-56-12((3(4methoxyphenyl)66dimethyl4oxo3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)N(2phenylethyl)acetamide
2((3(4methoxyphenyl)66dimethyl4oxo4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)Nphenethylacetamide
2((3(4methoxyphenyl)66dimethyl4oxo58dihydropyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)N(2phenylethyl)acetamide
799830561
CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC(=O)NCCC4=CC=CC=C4)C5=CC=C(C=C5)OC)C
InChI=1SC28H29N3O4S2c128(2)152122(163528)372524(21)26(33)31(1991120(343)121019)27(3025)361723(32)291413187546818h412H1317H213H3(H2932)
MFCD03684102
ZINC000002245686
ZINC2245686
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