Vitas-M small molecule compound
3-[(furan-2-ylmethyl)sulfanyl]-6-[(2-methoxy-5-methylphenyl)amino]-4-(1H-pyrrol-1-yl)-1,2,4-triazin-5(4H)-one
Catalog ID
STL274970
SMILES COc1ccc(cc1Nc1nnc(n(c1=O)n1cccc1)SCc1ccco1)C
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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 C20H19N5O3S MW 409.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O3S/c1-14-7-8-17(27-2)16(12-14)21-18-19(26)25(24-9-3-4-10-24)20(23-22-18)29-13-15-6-5-11-28-15/h3-12H,13H2,1-2H3,(H,21,22)InChIKey
IUJPEKSSJXKVBI-UHFFFAOYSA-NSynonyms
3((furan2ylmethyl)sulfanyl)6((2methoxy5methylphenyl)amino)4(1Hpyrrol1yl)124triazin5(4H)one
3(furan2ylmethylsulfanyl)6(2methoxy5methylanilino)4pyrrol1yl124triazin5one
CC1=CC(=C(C=C1)OC)NC2=NN=C(N(C2=O)N3C=CC=C3)SCC4=CC=CO4
InChI=1SC20H19N5O3Sc1147817(272)16(1214)211819(26)25(249341024)20(232218)29131565112815h312H13H212H3(H2122)
MFCD24854071
ZINC000028536330
ZINC28536330
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