Vitas-M small molecule compound
2-{[4-(2-bromo-4-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethyl-6-nitrophenyl)acetamide
Catalog ID
STK687069
SMILES Cc1ccc(c(c1)Br)n1c(SCC(=O)Nc2c(C)cc(cc2[N+](=O)[O-])C)nnc1c1ccncc1
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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 C24H21BrN6O3S MW 553.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21BrN6O3S/c1-14-4-5-19(18(25)11-14)30-23(17-6-8-26-9-7-17)28-29-24(30)35-13-21(32)27-22-16(3)10-15(2)12-20(22)31(33)34/h4-12H,13H2,1-3H3,(H,27,32)InChIKey
RLFSYBPPKJPTRS-UHFFFAOYSA-NSynonyms
889948-84-92((4(2BROMO4METHYLPHENYL)5(PYRIDIN4YL)4H124TRIAZOL3YL)SULFANYL)N(24DIMETHYL6NITROPHENYL)ACETAMIDE
2((4(2BROMO4METHYLPHENYL)5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)N(24DIMETHYL6NITROPHENYL)ACETAMIDE
889948849
CC1=CC(=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=C(C=C3(N+)(=O)(O))C)C)C4=CC=NC=C4)Br
Cc1ccc(c(c1)Br)n1c(SCC(=O)Nc2c(C)cc(cc2(N+)(=O)(O))C)nnc1c1ccncc1
InChI=1SC24H21BrN6O3Sc1144519(18(25)1114)3023(1768269717)282924(30)351321(32)272216(3)1015(2)1220(22)31(33)34h412H13H213H3(H2732)
MFCD06617303
ZINC000098008153
ZINC98008153
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