Vitas-M small molecule compound
2-{[3-benzyl-4-oxo-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(2-chlorophenyl)acetamide
Catalog ID
STK545417
SMILES O=C(Nc1ccccc1Cl)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(OC3)C(C)C
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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 C27H26ClN3O3S2 MW 540.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN3O3S2/c1-16(2)21-12-18-22(14-34-21)36-25-24(18)26(33)31(13-17-8-4-3-5-9-17)27(30-25)35-15-23(32)29-20-11-7-6-10-19(20)28/h3-11,16,21H,12-15H2,1-2H3,(H,29,32)InChIKey
AVEHWOCZZCSXIN-UHFFFAOYSA-NSynonyms
489403-23-82((3benzyl4oxo6(propan2yl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)N(2chlorophenyl)acetamide
2((3benzyl4oxo6propan2yl68dihydro5Hpyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)N(2chlorophenyl)acetamide
2((3benzyl6isopropyl4oxo4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)N(2chlorophenyl)acetamide
489403238
CC(C)C1CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC(=O)NC4=CC=CC=C4Cl)CC5=CC=CC=C5
InChI=1SC27H26ClN3O3S2c116(2)21121822(143421)362524(18)26(33)31(13178435917)27(3025)351523(32)292011761019(20)28h3111621H1215H212H3(H2932)
MFCD03296029
ZINC000002861773
ZINC000002861774
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