Vitas-M small molecule compound
1-cyclopropyl-3-[N'-(4,6-dimethylpyrimidin-2-yl)-N-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)carbamimidoyl]thiourea
Catalog ID
STK513572
SMILES S=C(N/C(=N\c1nc(C)cc(n1)C)/NCCSCc1nc[nH]c1C)NC1CC1
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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 C18H26N8S2 MW 418.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H26N8S2/c1-11-8-12(2)23-17(22-11)25-16(26-18(27)24-14-4-5-14)19-6-7-28-9-15-13(3)20-10-21-15/h8,10,14H,4-7,9H2,1-3H3,(H,20,21)(H3,19,22,23,24,25,26,27)InChIKey
LZRBHHZTTLTIJP-UHFFFAOYSA-NSynonyms
(((1Z)2(46DIMETHYLPYRIMIDIN2YL)1((2((5METHYLIMIDAZOL4YL)METHYLTHIO)ETHYL)AMINO)2AZAVINYL)AMINO)(CYCLOPROPYLAMINO)METHANE1THIONE
1cyclopropyl3(N(46dimethylpyrimidin2yl)N(2(((5methyl1Himidazol4yl)methyl)sulfanyl)ethyl)carbamimidoyl)thiourea
1cyclopropyl3(N(46dimethylpyrimidin2yl)N(2((5methyl1Himidazol4yl)methylsulfanyl)ethyl)carbamimidoyl)thiourea
CC1=CC(=NC(=N1)NC(=NCCSCC2=C(NC=N2)C)NC(=S)NC3CC3)C
InChI=1SC18H26N8S2c111812(2)2317(2211)2516(2618(27)24144514)19672891513(3)20102115h81014H479H213H3(H2021)(H319222324252627)
MFCD09762010
S=C(NC(=Nc1nc(C)cc(n1)C)NCCSCc1nc(nH)c1C)NC1CC1
ZINC000016283474
ZINC16283474
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