Vitas-M small molecule compound

prop-2-en-1-yl N-(4-oxoquinazolin-3(4H)-yl)piperidine-1-carbimidothioate

Catalog ID
STK759533
SMILES C=CCS/C(=N\n1cnc2c(c1=O)cccc2)/N1CCCCC1

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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 C17H20N4OS MW 328.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4OS/c1-2-12-23-17(20-10-6-3-7-11-20)19-21-13-18-15-9-5-4-8-14(15)16(21)22/h2,4-5,8-9,13H,1,3,6-7,10-12H2/b19-17-
InChIKey
KEVDOQFNIBBHDJ-ZPHPHTNESA-N
Synonyms

3((1Z)2PIPERIDYL2PROP2ENYLTHIO1AZAVINYL)3HYDROQUINAZOLIN4ONE
ALLYLN(4OXO3(4H)QUINAZOLINYL)1PIPERIDINECARBIMIDOTHIOATE
ALLYLN(4OXOQUINAZOLIN3(4H)YL)PIPERIDINE1CARBIMIDOTHIOATE
C=CCSC(=NN1C=NC2=CC=CC=C2C1=O)N3CCCCC3
C=CCSC(=Nn1cnc2c(c1=O)cccc2)N1CCCCC1
InChI=1SC17H20N4OSc12122317(20106371120)1921131815954814(15)16(21)22h2458913H13671012H2b1917
MFCD01461698
N(4KETOQUINAZOLIN3YL)PIPERIDINE1CARBOXIMIDOTHIOICACIDALLYLESTER
N(4OXO3QUINAZOLINYL)1PIPERIDINECARBOXIMIDOTHIOICACIDPROP2ENYLESTER
prop2en1ylN(4oxoquinazolin3(4H)yl)piperidine1carbimidothioate
PROP2ENYL(1Z)N(4OXOQUINAZOLIN3YL)PIPERIDINE1CARBOXIMIDOTHIOATE
PROP2ENYLN(4OXIDANYLIDENEQUINAZOLIN3YL)PIPERIDINE1CARBOXIMIDOTHIOATE
PROP2ENYLN(4OXOQUINAZOLIN3YL)PIPERIDINE1CARBOXIMIDOTHIOATE
ZINC000002189955
ZINC2189956

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Available files

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