Vitas-M small molecule compound

5-bromo-N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methoxy-3-methylbenzamide

Catalog ID
STK323630
SMILES COc1ccc(c(c1)NC(=S)NC(=O)c1cc(Br)cc(c1OC)C)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 C18H19BrN2O4S MW 439.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19BrN2O4S/c1-10-7-11(19)8-13(16(10)25-4)17(22)21-18(26)20-14-9-12(23-2)5-6-15(14)24-3/h5-9H,1-4H3,(H2,20,21,22,26)
InChIKey
WJTGDGPIYJRPCW-UHFFFAOYSA-N
Synonyms

1(5BROMO2METHOXY3METHYLBENZOYL)3(25DIMETHOXYPHENYL)THIOUREA
5bromoN((25dimethoxyphenyl)carbamothioyl)2methoxy3methylbenzamide
CC1=C(C(=CC(=C1)Br)C(=O)NC(=S)NC2=C(C=CC(=C2)OC)OC)OC
InChI=1SC18H19BrN2O4Sc110711(19)813(16(10)254)17(22)2118(26)2014912(232)5615(14)243h59H14H3(H220212226)
MFCD05848237
ZINC000001124830
ZINC01124830
ZINC1124830

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Available files

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