Vitas-M small molecule compound

3-{[(4-oxo-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}benzonitrile

Catalog ID
STK736354
SMILES N#Cc1cccc(c1)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCC3

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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 C23H17N3OS2 MW 415.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3OS2/c24-13-15-6-4-7-16(12-15)14-28-23-25-21-20(18-10-5-11-19(18)29-21)22(27)26(23)17-8-2-1-3-9-17/h1-4,6-9,12H,5,10-11,14H2
InChIKey
LLCBQLAQJIZBCS-UHFFFAOYSA-N
Synonyms

3(((4oxo3phenyl3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin2yl)sulfanyl)methyl)benzonitrile
3((1oxo2phenyl78dihydro6Hcyclopenta(23)thieno(24b)pyrimidin3yl)sulfanylmethyl)benzonitrile
C1CC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC4=CC=CC(=C4)C#N)C5=CC=CC=C5
InChI=1SC23H17N3OS2c24131564716(1215)142823252120(181051119(18)2921)22(27)26(23)178213917h146912H5101114H2
MFCD06903397
ZINC000004769771
ZINC04769771
ZINC4769771

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Available files

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