Vitas-M small molecule compound

N-(prop-2-en-1-yl)-4-(2-{[(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}ethyl)piperazine-1-carbothioamide

Catalog ID
STK093221
SMILES C=CCNC(=S)N1CCN(CC1)CCNC=C1C(=O)NC(=O)NC1=O

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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 C15H22N6O3S MW 366.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H22N6O3S/c1-2-3-17-15(25)21-8-6-20(7-9-21)5-4-16-10-11-12(22)18-14(24)19-13(11)23/h2,10,16H,1,3-9H2,(H,17,25)(H2,18,19,22,23,24)
InChIKey
ULPOTHAJNSMTCV-UHFFFAOYSA-N
Synonyms

5(((2(4((PROP2ENYLAMINO)THIOXOMETHYL)PIPERAZINYL)ETHYL)AMINO)METHYLENE)13DIHYDROPYRIMIDINE246TRIONE
C=CCNC(=S)N1CCN(CC1)CCNC=C1C(=O)NC(=O)NC1=O
C=CCNC(=S)N1CCN(CC1)CCNC=C2C(=O)NC(=O)NC2=O
InChI=1SC15H22N6O3Sc1231715(25)218620(7921)5416101112(22)1814(24)1913(11)23h21016H139H2(H1725)(H21819222324)
MFCD03194879
N(PROP2EN1YL)4(2(((246TRIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)AMINO)ETHYL)PIPERAZINE1CARBOTHIOAMIDE
NALLYL4(2(((246TRIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)AMINO)ETHYL)PIPERAZINE1CARBOTHIOAMIDE
NPROP2ENYL4(2((246TRIOXO13DIAZINAN5YLIDENE)METHYLAMINO)ETHYL)PIPERAZINE1CARBOTHIOAMIDE
STK093221
ZINC000085434211
ZINC85434211

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Available files

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