Vitas-M small molecule compound
2-bromo-N-{4-[5-({2-[(5-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]phenyl}benzamide
Catalog ID
STK147473
SMILES O=C(Nc1cc(Cl)ccc1C)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 C25H21BrClN5O2S MW 570.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21BrClN5O2S/c1-15-7-10-17(27)13-21(15)29-22(33)14-35-25-31-30-23(32(25)2)16-8-11-18(12-9-16)28-24(34)19-5-3-4-6-20(19)26/h3-13H,14H2,1-2H3,(H,28,34)(H,29,33)InChIKey
POATWRLBFMRRJY-UHFFFAOYSA-NSynonyms
2BROMON(4(5((2((5CHLORO2METHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)PHENYL)BENZAMIDE
2BROMON(4(5((2(5CHLORO2METHYLANILINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)PHENYL)BENZAMIDE
2BROMON(4(5(2(5CHLORO2METHYLANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)PHENYL)BENZAMIDE
CC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NN=C(N2C)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4Br
InChI=1SC25H21BrClN5O2Sc11571017(27)1321(15)2922(33)143525313023(32(25)2)1681118(12916)2824(34)19534620(19)26h313H14H212H3(H2834)(H2933)
MFCD04153216
ZINC000000624597
ZINC00624597
ZINC624597
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