Vitas-M small molecule compound
2-[(7-ethyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(3-nitrophenyl)acetamide
Catalog ID
STK733341
SMILES CCC1CCc2c(C1)sc1c2c(=O)n(c(n1)SCC(=O)Nc1cccc(c1)[N+](=O)[O-])c1ccccc1
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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 C26H24N4O4S2 MW 520.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N4O4S2/c1-2-16-11-12-20-21(13-16)36-24-23(20)25(32)29(18-8-4-3-5-9-18)26(28-24)35-15-22(31)27-17-7-6-10-19(14-17)30(33)34/h3-10,14,16H,2,11-13,15H2,1H3,(H,27,31)InChIKey
DUVAEBKYQUAELV-UHFFFAOYSA-NSynonyms
345987-08-82((7ethyl4oxo3phenyl345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N(3nitrophenyl)acetamide
2((7ethyl4oxo3phenyl345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)N(3nitrophenyl)acetamide
2((7ethyl4oxo3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N(3nitrophenyl)acetamide
345987088
CCC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)NC4=CC(=CC=C4)(N+)(=O)(O))C5=CC=CC=C5
CCC1CCc2c(C1)sc1c2c(=O)n(c(n1)SCC(=O)Nc1cccc(c1)(N+)(=O)(O))c1ccccc1
InChI=1SC26H24N4O4S2c121611122021(1316)362423(20)25(32)29(188435918)26(2824)351522(31)2717761019(1417)30(33)34h3101416H2111315H21H3(H2731)
MFCD01141048
ZINC000002352140
ZINC000002352142
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