Vitas-M small molecule compound

2-bromo-N-{[5-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}benzamide

Catalog ID
STK186646
SMILES C=CCn1c(SCC(=O)Nc2ccccc2)nnc1CNC(=O)c1ccccc1Br

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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 C21H20BrN5O2S MW 486.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BrN5O2S/c1-2-12-27-18(13-23-20(29)16-10-6-7-11-17(16)22)25-26-21(27)30-14-19(28)24-15-8-4-3-5-9-15/h2-11H,1,12-14H2,(H,23,29)(H,24,28)
InChIKey
YZBUQAHCJFVMHG-UHFFFAOYSA-N
Synonyms

2BROMON((5((2OXO2(PHENYLAMINO)ETHYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOL3YL)METHYL)BENZAMIDE
C=CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2)CNC(=O)C3=CC=CC=C3Br
InChI=1SC21H20BrN5O2Sc12122718(132320(29)1610671117(16)22)252621(27)301419(28)24158435915h211H11214H2(H2329)(H2428)
MFCD05998864
N((5(2ANILINO2OXOETHYL)SULFANYL4PROP2ENYL124TRIAZOL3YL)METHYL)2BROMOBENZAMIDE
ZINC000002866975
ZINC02866975
ZINC2866975

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Available files

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