Vitas-M small molecule compound
2-{[3-(4-bromophenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide
Catalog ID
STK044478
SMILES Brc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cc(cc2C)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 C27H26BrN3O2S2 MW 568.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26BrN3O2S2/c1-15-12-16(2)24(17(3)13-15)29-22(32)14-34-27-30-25-23(20-6-4-5-7-21(20)35-25)26(33)31(27)19-10-8-18(28)9-11-19/h8-13H,4-7,14H2,1-3H3,(H,29,32)InChIKey
HVXFJCPEYZPFNG-UHFFFAOYSA-NSynonyms
2((3(4bromophenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N(246trimethylphenyl)acetamide
2((3(4bromophenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)Nmesitylacetamide
2((3(4bromophenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N(246trimethylphenyl)acetamide
Brc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cc(cc2C)C)nc2c(c1=O)c1CCCCc1s2
CC1=CC(=C(C(=C1)C)NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=C(C=C5)Br)C
InChI=1SC27H26BrN3O2S2c1151216(2)24(17(3)1315)2922(32)143427302523(20645721(20)3525)26(33)31(27)1910818(28)91119h813H4714H213H3(H2932)
MFCD03223165
STK044478
ZINC000001750941
ZINC01750941
ZINC1750941
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