Vitas-M small molecule compound

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

Catalog ID
STK346274
SMILES COc1ccc(cc1Cl)n1nc2c(n1)cc(c(c2)C)NC(=S)NC(=O)c1ccccc1OC

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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/c1-13-10-18-19(28-29(27-18)14-8-9-21(32-3)16(24)11-14)12-17(13)25-23(33)26-22(30)15-6-4-5-7-20(15)31-2/h4-12H,1-3H3,(H2,25,26,30,33)
InChIKey
JVJRXLMRDQXYON-UHFFFAOYSA-N
Synonyms

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C3=CC=CC=C3OC)C4=CC(=C(C=C4)OC)Cl
InChI=1SC23H20ClN5O3Sc113101819(2829(2718)148921(323)16(24)1114)1217(13)2523(33)2622(30)15645720(15)312h412H13H3(H225263033)
MFCD02922807
N(((2(3CHLORO4METHOXYPHENYL)6METHYL(2HYDROBENZOTRIAZOL5YL))AMINO)THIOXOMETHYL)(2METHOXYPHENYL)CARBOXAMIDE
N((2(3CHLORO4METHOXYPHENYL)6METHYL2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)2METHOXYBENZAMIDE
N((2(3CHLORO4METHOXYPHENYL)6METHYLBENZOTRIAZOL5YL)CARBAMOTHIOYL)2METHOXYBENZAMIDE
ZINC000001180136
ZINC01180136
ZINC1180136

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Available files

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