Vitas-M small molecule compound
3-[(3-methylbenzyl)sulfanyl]-6-[(3-methylphenyl)amino]-4-(1H-pyrrol-1-yl)-1,2,4-triazin-5(4H)-one
Catalog ID
STL274424
SMILES Cc1cccc(c1)CSc1nnc(c(=O)n1n1cccc1)Nc1cccc(c1)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 C22H21N5OS MW 403.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5OS/c1-16-7-5-9-18(13-16)15-29-22-25-24-20(23-19-10-6-8-17(2)14-19)21(28)27(22)26-11-3-4-12-26/h3-14H,15H2,1-2H3,(H,23,24)InChIKey
CSGVWNBAMHQZOE-UHFFFAOYSA-NSynonyms
3((3methylbenzyl)sulfanyl)6((3methylphenyl)amino)4(1Hpyrrol1yl)124triazin5(4H)one
6(3methylanilino)3((3methylphenyl)methylsulfanyl)4pyrrol1yl124triazin5one
CC1=CC(=CC=C1)CSC2=NN=C(C(=O)N2N3C=CC=C3)NC4=CC=CC(=C4)C
InChI=1SC22H21N5OSc11675918(1316)152922252420(2319106817(2)1419)21(28)27(22)2611341226h314H15H212H3(H2324)
MFCD24853743
ZINC000028535089
ZINC28535089
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