Vitas-M small molecule compound
9-(2-chlorophenyl)-2-[(pyridin-2-ylmethyl)sulfanyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK335405
SMILES O=C1CCCC2=C1C(c1ccccc1Cl)n1c(N2)nc(n1)SCc1ccccn1
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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 C21H18ClN5OS MW 423.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN5OS/c22-15-8-2-1-7-14(15)19-18-16(9-5-10-17(18)28)24-20-25-21(26-27(19)20)29-12-13-6-3-4-11-23-13/h1-4,6-8,11,19H,5,9-10,12H2,(H,24,25,26)InChIKey
UYDSFBXBIQMNCC-UHFFFAOYSA-NSynonyms
9(2chlorophenyl)2((pyridin2ylmethyl)sulfanyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(2chlorophenyl)2(pyridin2ylmethylsulfanyl)5679tetrahydro1H(124)triazolo(51b)quinazolin8one
C1CC2=C(C(N3C(=N2)N=C(N3)SCC4=CC=CC=N4)C5=CC=CC=C5Cl)C(=O)C1
InChI=1SC21H18ClN5OSc2215821714(15)191816(951017(18)28)24202521(2627(19)20)291213634112313h14681119H591012H2(H242526)
MFCD09799233
ZINC000018198866
ZINC000018198868
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