Vitas-M small molecule compound
2-{2-[4-(4-methoxyphenyl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethyl}phthalazin-1(2H)-one
Catalog ID
STK597332
SMILES COc1ccc(cc1)n1c(n[nH]c1=S)CCn1ncc2c(c1=O)cccc2
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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 C19H17N5O2S MW 379.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N5O2S/c1-26-15-8-6-14(7-9-15)24-17(21-22-19(24)27)10-11-23-18(25)16-5-3-2-4-13(16)12-20-23/h2-9,12H,10-11H2,1H3,(H,22,27)InChIKey
NCZYRDQTBFCRES-UHFFFAOYSA-NSynonyms
879444-19-62(2(4(4METHOXYPHENYL)5SULFANYLIDENE1H124TRIAZOL3YL)ETHYL)PHTHALAZIN1ONE
2(2(4(4METHOXYPHENYL)5THIOXO1H124TRIAZOL3YL)ETHYL)PHTHALAZIN1ONE
2(2(4(4methoxyphenyl)5thioxo45dihydro1H124triazol3yl)ethyl)phthalazin1(2H)one
879444196
COC1=CC=C(C=C1)N2C(=NNC2=S)CCN3C(=O)C4=CC=CC=C4C=N3
COc1ccc(cc1)n1c(n(nH)c1=S)CCn1ncc2c(c1=O)cccc2
InChI=1SC19H17N5O2Sc126158614(7915)2417(212219(24)27)10112318(25)16532413(16)122023h2912H1011H21H3(H2227)
MFCD07204437
ZINC000005695541
ZINC02341966
ZINC05695541
ZINC5695541
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