Vitas-M small molecule compound
2-(benzylsulfanyl)-6-(3-chlorobenzyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Catalog ID
STK250945
SMILES Clc1cccc(c1)Cc1c(C)[nH]c2n(c1=O)nc(n2)SCc1ccccc1
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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 C20H17ClN4OS MW 396.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN4OS/c1-13-17(11-15-8-5-9-16(21)10-15)18(26)25-19(22-13)23-20(24-25)27-12-14-6-3-2-4-7-14/h2-10H,11-12H2,1H3,(H,22,23,24)InChIKey
GEVQESVCEWFYQL-UHFFFAOYSA-NSynonyms
898926-29-92(benzylsulfanyl)6(3chlorobenzyl)5methyl(124)triazolo(15a)pyrimidin7(4H)one
2(benzylthio)6(3chlorobenzyl)5methyl(124)triazolo(15a)pyrimidin7(4H)one
2benzylsulfanyl6((3chlorophenyl)methyl)5methyl1H(124)triazolo(15a)pyrimidin7one
6((3CHLOROPHENYL)METHYL)5METHYL2(PHENYLMETHYLTHIO)48DIHYDRO124TRIAZOLO(15A)PYRIMIDIN7ONE
898926299
CC1=C(C(=O)N2C(=N1)N=C(N2)SCC3=CC=CC=C3)CC4=CC(=CC=C4)Cl
Clc1cccc(c1)Cc1c(C)(nH)c2n(c1=O)nc(n2)SCc1ccccc1
InChI=1SC20H17ClN4OSc11317(111585916(21)1015)18(26)2519(2213)2320(2425)2712146324714h210H1112H21H3(H222324)
MFCD07638890
ZINC000100133730
ZINC100133730
ZINC18029783
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