Vitas-M small molecule compound
5-bromo-N-{[2-(4-butylphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}-2-methoxybenzamide
Catalog ID
STK327089
SMILES CCCCc1ccc(cc1)n1nc2c(n1)cc(c(c2)C)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 C26H26BrN5O2S MW 552.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26BrN5O2S/c1-4-5-6-17-7-10-19(11-8-17)32-30-22-13-16(2)21(15-23(22)31-32)28-26(35)29-25(33)20-14-18(27)9-12-24(20)34-3/h7-15H,4-6H2,1-3H3,(H2,28,29,33,35)InChIKey
BXODZIKCBBRZBZ-UHFFFAOYSA-NSynonyms
5bromoN((2(4butylphenyl)6methyl2Hbenzotriazol5yl)carbamothioyl)2methoxybenzamide
5BROMON((2(4BUTYLPHENYL)6METHYLBENZOTRIAZOL5YL)CARBAMOTHIOYL)2METHOXYBENZAMIDE
CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)C4=C(C=CC(=C4)Br)OC)C
InChI=1SC26H26BrN5O2Sc14561771019(11817)3230221316(2)21(1523(22)3132)2826(35)2925(33)201418(27)91224(20)343h715H46H213H3(H228293335)
MFCD03786044
N(5BROMO2METHOXYBENZOYL)N(2(4BUTYLPHENYL)6METHYL2H123BENZOTRIAZOL5YL)THIOUREA
ZINC000008437799
ZINC08437799
ZINC8437799
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