Vitas-M small molecule compound
4-butoxy-N-{[2-(4-butylphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}benzamide
Catalog ID
STK237220
SMILES CCCCOc1ccc(cc1)C(=O)NC(=S)Nc1cc2nn(nc2cc1C)c1ccc(cc1)CCCC
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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 C29H33N5O2S MW 515.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N5O2S/c1-4-6-8-21-9-13-23(14-10-21)34-32-26-18-20(3)25(19-27(26)33-34)30-29(37)31-28(35)22-11-15-24(16-12-22)36-17-7-5-2/h9-16,18-19H,4-8,17H2,1-3H3,(H2,30,31,35,37)InChIKey
FLZUHTOXZFTBQX-UHFFFAOYSA-NSynonyms
4butoxyN((2(4butylphenyl)6methyl2Hbenzotriazol5yl)carbamothioyl)benzamide
4BUTOXYN((2(4BUTYLPHENYL)6METHYLBENZOTRIAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)C4=CC=C(C=C4)OCCCC)C
InChI=1SC29H33N5O2Sc14682191323(141021)3432261820(3)25(1927(26)3334)3029(37)3128(35)22111524(161222)3617752h9161819H4817H213H3(H230313537)
MFCD04095448
ZINC000009190530
ZINC09190530
ZINC9190530
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