Vitas-M small molecule compound
5-bromo-N-{[2-(4-butylphenyl)-6-chloro-2H-benzotriazol-5-yl]carbamothioyl}-2-methoxybenzamide
Catalog ID
STK327837
SMILES CCCCc1ccc(cc1)n1nc2c(n1)cc(c(c2)Cl)NC(=S)NC(=O)c1cc(Br)ccc1OC
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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 C25H23BrClN5O2S MW 572.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23BrClN5O2S/c1-3-4-5-15-6-9-17(10-7-15)32-30-21-13-19(27)20(14-22(21)31-32)28-25(35)29-24(33)18-12-16(26)8-11-23(18)34-2/h6-14H,3-5H2,1-2H3,(H2,28,29,33,35)InChIKey
JRCDSJVQKQPXOA-UHFFFAOYSA-NSynonyms
5bromoN((2(4butylphenyl)6chloro2Hbenzotriazol5yl)carbamothioyl)2methoxybenzamide
5BROMON((2(4BUTYLPHENYL)6CHLOROBENZOTRIAZOL5YL)CARBAMOTHIOYL)2METHOXYBENZAMIDE
CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=S)NC(=O)C4=C(C=CC(=C4)Br)OC
InChI=1SC25H23BrClN5O2Sc1345156917(10715)3230211319(27)20(1422(21)3132)2825(35)2924(33)181216(26)81123(18)342h614H35H212H3(H228293335)
MFCD03907746
ZINC000100357610
ZINC100357610
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