Vitas-M small molecule compound

N-{[3-chloro-4-(piperidin-1-yl)phenyl]carbamothioyl}-2-methoxybenzamide

Catalog ID
STK028721
SMILES COc1ccccc1C(=O)NC(=S)Nc1ccc(c(c1)Cl)N1CCCCC1

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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 C20H22ClN3O2S MW 403.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClN3O2S/c1-26-18-8-4-3-7-15(18)19(25)23-20(27)22-14-9-10-17(16(21)13-14)24-11-5-2-6-12-24/h3-4,7-10,13H,2,5-6,11-12H2,1H3,(H2,22,23,25,27)
InChIKey
OUHYVMRLNNJJMN-UHFFFAOYSA-N
Synonyms

1(3CHLORO4PIPERIDIN1YLPHENYL)3(2METHOXYBENZOYL)THIOUREA
COC1=CC=CC=C1C(=O)NC(=S)NC2=CC(=C(C=C2)N3CCCCC3)Cl
COc1ccccc1C(=O)NC(=S)Nc1ccc(c(c1)Cl)N1CCCCC1
InChI=1SC20H22ClN3O2Sc12618843715(18)19(25)2320(27)221491017(16(21)1314)24115261224h3471013H2561112H21H3(H222232527)
MFCD02578336
N((3CHLORO4(PIPERIDIN1YL)PHENYL)CARBAMOTHIOYL)2METHOXYBENZAMIDE
N((3CHLORO4PIPERIDIN1YLPHENYL)CARBAMOTHIOYL)2METHOXYBENZAMIDE
N(3CHLORO4(1PIPERIDINYL)PHENYL)N(2METHOXYBENZOYL)THIOUREA
STK028721
ZINC000000669822
ZINC00669822
ZINC669822

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Available files

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