Vitas-M small molecule compound
N-(2,6-dimethylphenyl)-2-{[3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STK096691
SMILES COc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cccc2C)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 C27H27N3O3S2 MW 505.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O3S2/c1-16-7-6-8-17(2)24(16)28-22(31)15-34-27-29-25-23(20-9-4-5-10-21(20)35-25)26(32)30(27)18-11-13-19(33-3)14-12-18/h6-8,11-14H,4-5,9-10,15H2,1-3H3,(H,28,31)InChIKey
GIIXFMBBPZBBGT-UHFFFAOYSA-NSynonyms
477330-21-5477330215
CC1=C(C(=CC=C1)C)NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=C(C=C5)OC
COc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cccc2C)nc2c(c1=O)c1CCCCc1s2
InChI=1SC27H27N3O3S2c11676817(2)24(16)2822(31)153427292523(209451021(20)3525)26(32)30(27)18111319(333)141218h681114H4591015H213H3(H2831)
MFCD03223556
N(26dimethylphenyl)2((3(4methoxyphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(26dimethylphenyl)2((3(4methoxyphenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamide
N(26dimethylphenyl)2((3(4methoxyphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
STK096691
ZINC000001820962
ZINC01820962
ZINC1820962
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Check stock on Vitas-MAvailable files
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