Vitas-M small molecule compound

3-(4-iodophenyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one

Catalog ID
STK052104
SMILES Ic1ccc(cc1)n1cnc2c(c1=O)c1CCCCCc1s2

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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 C17H15IN2OS MW 422.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15IN2OS/c18-11-6-8-12(9-7-11)20-10-19-16-15(17(20)21)13-4-2-1-3-5-14(13)22-16/h6-10H,1-5H2
InChIKey
ZJNIEBAKPYDQEB-UHFFFAOYSA-N
Synonyms

3(4iodophenyl)356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
3(4iodophenyl)6789tetrahydro5Hcyclohepta(23)thieno(24d)pyrimidin4one
C1CCC2=C(CC1)SC3=C2C(=O)N(C=N3)C4=CC=C(C=C4)I
Ic1ccc(cc1)n1cnc2c(c1=O)c1CCCCCc1s2
InChI=1SC17H15IN2OSc18116812(9711)2010191615(17(20)21)134213514(13)2216h610H15H2
MFCD03252539
STK052104
ZINC000001129438
ZINC01129438
ZINC1129438

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Available files

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