Vitas-M small molecule compound
2-{[(E)-(1-cyclohexyl-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]amino}-N,N,N-trimethylethanaminium
Catalog ID
STL043333
SMILES O=C1N=C(S)N(C(=O)/C/1=C/NCC[N+](C)(C)C)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 C16H27N4O2S MW 339.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H26N4O2S/c1-20(2,3)10-9-17-11-13-14(21)18-16(23)19(15(13)22)12-7-5-4-6-8-12/h11-12H,4-10H2,1-3H3,(H-,17,18,21,22,23)/p+1InChIKey
QOLLKLJYGLTWTF-UHFFFAOYSA-OSynonyms
2(((E)(1cyclohexyl46dioxo2sulfanyl16dihydropyrimidin5(4H)ylidene)methyl)amino)NNNtrimethylethanaminium
2((1CYCLOHEXYL46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYLAMINO)ETHYLTRIMETHYLAZANIUM
C(N+)(C)(C)CCNC=C1C(=O)NC(=S)N(C1=O)C2CCCCC2
InChI=1SC16H26N4O2Sc120(23)10917111314(21)1816(23)19(15(13)22)127546812h1112H410H213H3(H1718212223)p+1
O=C1N=C(S)N(C(=O)C1=CNCC(N+)(C)(C)C)C1CCCCC1
ZINC000006025076
ZINC06025076
ZINC6025076
Check stock
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