Vitas-M small molecule compound

4-bromo-N-{[5-({2-[(2,3-dichlorophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}benzamide

Catalog ID
STK140097
SMILES O=C(Nc1cccc(c1Cl)Cl)CSc1nnc(n1C)CNC(=O)c1ccc(cc1)Br

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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 C19H16BrCl2N5O2S MW 529.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16BrCl2N5O2S/c1-27-15(9-23-18(29)11-5-7-12(20)8-6-11)25-26-19(27)30-10-16(28)24-14-4-2-3-13(21)17(14)22/h2-8H,9-10H2,1H3,(H,23,29)(H,24,28)
InChIKey
RCAQSOUMJPQBBJ-UHFFFAOYSA-N
Synonyms

4BROMON((5((2((23DICHLOROPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)BENZAMIDE
4BROMON((5(2(23DICHLOROANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)BENZAMIDE
CN1C(=NN=C1SCC(=O)NC2=C(C(=CC=C2)Cl)Cl)CNC(=O)C3=CC=C(C=C3)Br
InChI=1SC19H16BrCl2N5O2Sc12715(92318(29)115712(20)8611)252619(27)301016(28)241442313(21)17(14)22h28H910H21H3(H2329)(H2428)
MFCD05986442
ZINC000001129022
ZINC1129022

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Available files

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