Vitas-M small molecule compound
2-{[3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Catalog ID
STK030261
SMILES COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(C)C)nc2c(c1=O)c1CCCCc1s2
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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 C28H29N3O3S2 MW 519.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O3S2/c1-17(2)18-8-10-19(11-9-18)29-24(32)16-35-28-30-26-25(22-6-4-5-7-23(22)36-26)27(33)31(28)20-12-14-21(34-3)15-13-20/h8-15,17H,4-7,16H2,1-3H3,(H,29,32)InChIKey
JDMZHWRKILWKFV-UHFFFAOYSA-NSynonyms
477332-66-42((3(4methoxyphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N(4(propan2yl)phenyl)acetamide
2((3(4methoxyphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N(4propan2ylphenyl)acetamide
477332664
CC(C)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=C(C=C5)OC
COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(C)C)nc2c(c1=O)c1CCCCc1s2
InChI=1SC28H29N3O3S2c117(2)1881019(11918)2924(32)163528302625(22645723(22)3626)27(33)31(28)20121421(343)151320h81517H4716H213H3(H2932)
MFCD03223568
N(4isopropylphenyl)2((3(4methoxyphenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamide
STK030261
ZINC000001835459
ZINC01835459
ZINC1835459
Check stock
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Check stock on Vitas-MAvailable files
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