Vitas-M small molecule compound

3,4-dimethoxy-N-{[6-methyl-2-(4-methylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}benzamide

Catalog ID
STK091655
SMILES COc1cc(ccc1OC)C(=O)NC(=S)Nc1cc2nn(nc2cc1C)c1ccc(cc1)C

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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 C24H23N5O3S MW 461.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N5O3S/c1-14-5-8-17(9-6-14)29-27-19-11-15(2)18(13-20(19)28-29)25-24(33)26-23(30)16-7-10-21(31-3)22(12-16)32-4/h5-13H,1-4H3,(H2,25,26,30,33)
InChIKey
JNPWHXBXAZENPL-UHFFFAOYSA-N
Synonyms
335213-61-1
1(34DIMETHOXYBENZOYL)3(6METHYL2PTOLYL2HBENZOTRIAZOL5YL)THIOUREA
335213611
34DIMETHOXYN((6METHYL2(4METHYLPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
34dimethoxyN((6methyl2(4methylphenyl)benzotriazol5yl)carbamothioyl)benzamide
34dimethoxyN((6methyl2(ptolyl)2Hbenzo(d)(123)triazol5yl)carbamothioyl)benzamide
CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)C4=CC(=C(C=C4)OC)OC)C
COc1cc(ccc1OC)C(=O)NC(=S)Nc1cc2nn(nc2cc1C)c1ccc(cc1)C
InChI=1SC24H23N5O3Sc1145817(9614)2927191115(2)18(1320(19)2829)2524(33)2623(30)1671021(313)22(1216)324h513H14H3(H225263033)
MFCD02577937
N(34DIMETHOXYBENZOYL)N(6METHYL2(4METHYLPHENYL)2H123BENZOTRIAZOL5YL)THIOUREA
STK091655
ZINC000000881493
ZINC00881493
ZINC881493

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.