Vitas-M small molecule compound
2-{[6-(4-methoxybenzyl)-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Catalog ID
STL266846
SMILES COc1ccc(cc1)Cc1nnc([nH]c1=O)SCC(=O)Nc1ccc(cc1)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 C20H20N4O3S MW 396.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O3S/c1-13-3-7-15(8-4-13)21-18(25)12-28-20-22-19(26)17(23-24-20)11-14-5-9-16(27-2)10-6-14/h3-10H,11-12H2,1-2H3,(H,21,25)(H,22,24,26)InChIKey
UISBSCBXUJIXED-UHFFFAOYSA-NSynonyms
881435-24-12((6((4METHOXYPHENYL)METHYL)5OXO2H124TRIAZIN3YL)SULFANYL)N(4METHYLPHENYL)ACETAMIDE
2((6(4methoxybenzyl)5oxo45dihydro124triazin3yl)sulfanyl)N(4methylphenyl)acetamide
2((6(4METHOXYBENZYL)5OXO45DIHYDRO124TRIAZIN3YL)THIO)N(PTOLYL)ACETAMIDE
881435241
CC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C(=NN2)CC3=CC=C(C=C3)OC
COc1ccc(cc1)Cc1nnc((nH)c1=O)SCC(=O)Nc1ccc(cc1)C
InChI=1SC20H20N4O3Sc1133715(8413)2118(25)1228202219(26)17(232420)11145916(272)10614h310H1112H212H3(H2125)(H222426)
MFCD06618995
ZINC000016777007
ZINC16777007
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