Vitas-M small molecule compound
2-{[5-amino-6-(4-chlorobenzyl)-4-oxo-4,5-dihydro-1,3,5-triazin-2-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide
Catalog ID
STL270703
SMILES O=C(Nc1c(C)cccc1C)CSc1nc(Cc2ccc(cc2)Cl)n(c(=O)n1)N
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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 C20H20ClN5O2S MW 429.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN5O2S/c1-12-4-3-5-13(2)18(12)24-17(27)11-29-19-23-16(26(22)20(28)25-19)10-14-6-8-15(21)9-7-14/h3-9H,10-11,22H2,1-2H3,(H,24,27)InChIKey
AXARIECZVSFLIS-UHFFFAOYSA-NSynonyms
2((5amino4((4chlorophenyl)methyl)6oxo135triazin2yl)sulfanyl)N(26dimethylphenyl)acetamide
2((5amino6(4chlorobenzyl)4oxo45dihydro135triazin2yl)sulfanyl)N(26dimethylphenyl)acetamide
CC1=C(C(=CC=C1)C)NC(=O)CSC2=NC(=O)N(C(=N2)CC3=CC=C(C=C3)Cl)N
InChI=1SC20H20ClN5O2Sc11243513(2)18(12)2417(27)1129192316(26(22)20(28)2519)10146815(21)9714h39H101122H212H3(H2427)
MFCD24853334
ZINC000027643471
ZINC27643471
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