Vitas-M small molecule compound

(3-cyclohexyl-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl)acetonitrile

Catalog ID
STK648403
SMILES N#CCn1c(=O)n(C2CCCCC2)c(=O)c2c1ccs2

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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 C14H15N3O2S MW 289.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N3O2S/c15-7-8-16-11-6-9-20-12(11)13(18)17(14(16)19)10-4-2-1-3-5-10/h6,9-10H,1-5,8H2
InChIKey
ODZFCQSSTRGCIX-UHFFFAOYSA-N
Synonyms
1144491-25-7
(3cyclohexyl24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)acetonitrile
1144491257
2(3cyclohexyl24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)acetonitrile
2(3cyclohexyl24dioxothieno(32d)pyrimidin1yl)acetonitrile
C1CCC(CC1)N2C(=O)C3=C(C=CS3)N(C2=O)CC#N
InChI=1SC14H15N3O2Sc15781611692012(11)13(18)17(14(16)19)104213510h6910H158H2
MFCD12218055
ZINC000032104755
ZINC32104755

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.