Vitas-M small molecule compound

ethyl 2-({[(2-bromophenyl)carbonyl]carbamothioyl}amino)-4-(3,4-dimethoxyphenyl)-5-methylthiophene-3-carboxylate

Catalog ID
STK044841
SMILES CCOC(=O)c1c(NC(=S)NC(=O)c2ccccc2Br)sc(c1c1ccc(c(c1)OC)OC)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 C24H23BrN2O5S2 MW 563.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23BrN2O5S2/c1-5-32-23(29)20-19(14-10-11-17(30-3)18(12-14)31-4)13(2)34-22(20)27-24(33)26-21(28)15-8-6-7-9-16(15)25/h6-12H,5H2,1-4H3,(H2,26,27,28,33)
InChIKey
GSVCDKRGTRGCGN-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C2=CC(=C(C=C2)OC)OC)C)NC(=S)NC(=O)C3=CC=CC=C3Br
CCOC(=O)c1c(NC(=S)NC(=O)c2ccccc2Br)sc(c1c1ccc(c(c1)OC)OC)C
ETHYL2((((2BROMOPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)4(34DIMETHOXYPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
ETHYL2(((2BROMOBENZOYL)CARBAMOTHIOYL)AMINO)4(34DIMETHOXYPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
ETHYL2((2BROMOBENZOYL)CARBAMOTHIOYLAMINO)4(34DIMETHOXYPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
ethyl2(3(2bromobenzoyl)thioureido)4(34dimethoxyphenyl)5methylthiophene3carboxylate
InChI=1SC24H23BrN2O5S2c153223(29)2019(14101117(303)18(1214)314)13(2)3422(20)2724(33)2621(28)15867916(15)25h612H5H214H3(H226272833)
MFCD03064955
STK044841
ZINC000002605645
ZINC2605645

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Available files

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