Vitas-M small molecule compound

3-bromo-N-[(4-butylphenyl)carbamothioyl]-4-methoxybenzamide

Catalog ID
STK031927
SMILES CCCCc1ccc(cc1)NC(=S)NC(=O)c1ccc(c(c1)Br)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 C19H21BrN2O2S MW 421.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21BrN2O2S/c1-3-4-5-13-6-9-15(10-7-13)21-19(25)22-18(23)14-8-11-17(24-2)16(20)12-14/h6-12H,3-5H2,1-2H3,(H2,21,22,23,25)
InChIKey
IRYKGGQEYQUKJL-UHFFFAOYSA-N
Synonyms

3BROMON((4BUTYLPHENYL)CARBAMOTHIOYL)4METHOXYBENZAMIDE
CCCCC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br
CCCCc1ccc(cc1)NC(=S)NC(=O)c1ccc(c(c1)Br)OC
InChI=1SC19H21BrN2O2Sc1345136915(10713)2119(25)2218(23)1481117(242)16(20)1214h612H35H212H3(H221222325)
MFCD02625153
STK031927
ZINC000002983115
ZINC02983115
ZINC2983115

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Available files

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