Vitas-M small molecule compound
2-bromo-N-{4-[4-methyl-5-({2-[(4-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]phenyl}benzamide
Catalog ID
STK205789
SMILES O=C(Nc1ccc(cc1)[N+](=O)[O-])CSc1nnc(n1C)c1ccc(cc1)NC(=O)c1ccccc1Br
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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 C24H19BrN6O4S MW 567.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19BrN6O4S/c1-30-22(15-6-8-17(9-7-15)27-23(33)19-4-2-3-5-20(19)25)28-29-24(30)36-14-21(32)26-16-10-12-18(13-11-16)31(34)35/h2-13H,14H2,1H3,(H,26,32)(H,27,33)InChIKey
IEEWLSKRQUTVNQ-UHFFFAOYSA-NSynonyms
2BROMON(4(4METHYL5((2((4NITROPHENYL)AMINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)PHENYL)BENZAMIDE
2BROMON(4(4METHYL5(2(4NITROANILINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)PHENYL)BENZAMIDE
CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)(N+)(=O)(O))C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4Br
InChI=1SC24H19BrN6O4Sc13022(156817(9715)2723(33)19423520(19)25)282924(30)361421(32)2616101218(131116)31(34)35h213H14H21H3(H2632)(H2733)
MFCD04388698
O=C(Nc1ccc(cc1)(N+)(=O)(O))CSc1nnc(n1C)c1ccc(cc1)NC(=O)c1ccccc1Br
ZINC000059608002
ZINC59608002
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