Vitas-M small molecule compound

N-{[6-chloro-2-(4-methylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-3,4-dimethoxybenzamide

Catalog ID
STK083500
SMILES COc1cc(ccc1OC)C(=O)NC(=S)Nc1cc2nn(nc2cc1Cl)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 C23H20ClN5O3S MW 481.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClN5O3S/c1-13-4-7-15(8-5-13)29-27-18-11-16(24)17(12-19(18)28-29)25-23(33)26-22(30)14-6-9-20(31-2)21(10-14)32-3/h4-12H,1-3H3,(H2,25,26,30,33)
InChIKey
VRXXBRZTBSDHKV-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=S)NC(=O)C4=CC(=C(C=C4)OC)OC
COc1cc(ccc1OC)C(=O)NC(=S)Nc1cc2nn(nc2cc1Cl)c1ccc(cc1)C
InChI=1SC23H20ClN5O3Sc1134715(8513)2927181116(24)17(1219(18)2829)2523(33)2622(30)146920(312)21(1014)323h412H13H3(H225263033)
MFCD03031464
N((6CHLORO2(4METHYLPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)34DIMETHOXYBENZAMIDE
N((6CHLORO2(4METHYLPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)34DIMETHOXYBENZAMIDE
STK083500
ZINC000001151701
ZINC01151701
ZINC1151701

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Available files

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