Vitas-M small molecule compound

N-{[2-(4-ethoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-3,4-dimethoxybenzamide

Catalog ID
STK099876
SMILES CCOc1ccc(cc1)n1nc2c(n1)cc(cc2)NC(=S)NC(=O)c1ccc(c(c1)OC)OC

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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 C24H23N5O4S MW 477.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N5O4S/c1-4-33-18-9-7-17(8-10-18)29-27-19-11-6-16(14-20(19)28-29)25-24(34)26-23(30)15-5-12-21(31-2)22(13-15)32-3/h5-14H,4H2,1-3H3,(H2,25,26,30,34)
InChIKey
USLDTNFPIRBNJC-UHFFFAOYSA-N
Synonyms
6409-18-3
1(34DIMETHOXYBENZOYL)3(2(4ETHOXYPHENYL)2HBENZOTRIAZOL5YL)THIOUREA
6409183
CCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC(=C(C=C4)OC)OC
CCOc1ccc(cc1)n1nc2c(n1)cc(cc2)NC(=S)NC(=O)c1ccc(c(c1)OC)OC
InChI=1SC24H23N5O4Sc1433189717(81018)29271911616(1420(19)2829)2524(34)2623(30)1551221(312)22(1315)323h514H4H213H3(H225263034)
MFCD02577936
N((2(4ethoxyphenyl)2Hbenzo(d)(123)triazol5yl)carbamothioyl)34dimethoxybenzamide
N((2(4ETHOXYPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)34DIMETHOXYBENZAMIDE
N((2(4ethoxyphenyl)benzotriazol5yl)carbamothioyl)34dimethoxybenzamide
N(34DIMETHOXYBENZOYL)N(2(4ETHOXYPHENYL)2H123BENZOTRIAZOL5YL)THIOUREA
STK099876
ZINC000000881491
ZINC00881491
ZINC881491

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Available files

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