Vitas-M small molecule compound

(5E)-1-cyclohexyl-5-({[2-(piperazin-1-yl)ethyl]amino}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STK549201
SMILES O=C1NC(=S)N(C(=O)/C/1=C/NCCN1CCNCC1)C1CCCCC1

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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 C17H27N5O2S MW 365.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H27N5O2S/c23-15-14(12-19-8-11-21-9-6-18-7-10-21)16(24)22(17(25)20-15)13-4-2-1-3-5-13/h12-13,18-19H,1-11H2,(H,20,23,25)/b14-12+
InChIKey
IRSFQSYDNWQKEQ-WYMLVPIESA-N
Synonyms

(5E)1cyclohexyl5(((2(piperazin1yl)ethyl)amino)methylidene)2thioxodihydropyrimidine46(1H5H)dione
(5E)1CYCLOHEXYL5((2PIPERAZIN1YLETHYLAMINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(E)1cyclohexyl5(((2(piperazin1yl)ethyl)amino)methylene)2thioxodihydropyrimidine46(1H5H)dione
C1CCC(CC1)N2C(=O)C(=CNCCN3CCNCC3)C(=O)NC2=S
InChI=1SC17H27N5O2Sc231514(121981121961871021)16(24)22(17(25)2015)134213513h12131819H111H2(H202325)b1412+
MFCD02993364
O=C1NC(=S)N(C(=O)C1=CNCCN1CCNCC1)C1CCCCC1
ZINC000020189032
ZINC000102452643
ZINC20189032

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Available files

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