Vitas-M small molecule compound

N-{[2-(3-chloro-4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}-3-methoxybenzamide

Catalog ID
STK236804
SMILES COc1cccc(c1)C(=O)NC(=S)Nc1cc2nn(nc2cc1C)c1ccc(c(c1)Cl)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 C23H20ClN5O3S MW 481.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClN5O3S/c1-13-9-19-20(28-29(27-19)15-7-8-21(32-3)17(24)11-15)12-18(13)25-23(33)26-22(30)14-5-4-6-16(10-14)31-2/h4-12H,1-3H3,(H2,25,26,30,33)
InChIKey
IBGLHLPBWXMWDF-UHFFFAOYSA-N
Synonyms
364597-12-6
364597126
CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C3=CC(=CC=C3)OC)C4=CC(=C(C=C4)OC)Cl
InChI=1SC23H20ClN5O3Sc11391920(2829(2719)157821(323)17(24)1115)1218(13)2523(33)2622(30)1454616(1014)312h412H13H3(H225263033)
MFCD02922913
N(((2(3CHLORO4METHOXYPHENYL)6METHYL(2HYDROBENZOTRIAZOL5YL))AMINO)THIOXOMETHYL)(3METHOXYPHENYL)CARBOXAMIDE
N((2(3chloro4methoxyphenyl)6methyl2Hbenzo(d)(123)triazol5yl)carbamothioyl)3methoxybenzamide
N((2(3CHLORO4METHOXYPHENYL)6METHYL2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)3METHOXYBENZAMIDE
N((2(3CHLORO4METHOXYPHENYL)6METHYLBENZOTRIAZOL5YL)CARBAMOTHIOYL)3METHOXYBENZAMIDE
ZINC000001099965
ZINC01099965
ZINC1099965

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Available files

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