Vitas-M small molecule compound
1-benzyl-6-cyclopentyl-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Catalog ID
STK587046
SMILES O=c1nc(S)n(c2c1CN(CN2)C1CCCC1)Cc1ccccc1
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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 C18H22N4OS MW 342.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4OS/c23-17-15-11-21(14-8-4-5-9-14)12-19-16(15)22(18(24)20-17)10-13-6-2-1-3-7-13/h1-3,6-7,14,19H,4-5,8-12H2,(H,20,23,24)InChIKey
BSIXBRDNOWTUSW-UHFFFAOYSA-NSynonyms
879563-17-41benzyl6cyclopentyl2sulfanyl5678tetrahydropyrimido(45d)pyrimidin4(1H)one
1benzyl6cyclopentyl2sulfanylidene78dihydro5Hpyrimido(45d)pyrimidin4one
879563174
C1CCC(C1)N2CC3=C(NC2)N(C(=S)NC3=O)CC4=CC=CC=C4
InChI=1SC18H22N4OSc2317151121(14845914)121916(15)22(18(24)2017)10136213713h13671419H45812H2(H202324)
MFCD07794215
ZINC000017028010
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