Vitas-M small molecule compound
2-bromo-N-{[5-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
Catalog ID
STK245681
SMILES C=CCn1c(CNC(=O)c2ccccc2Br)nnc1SCC(=O)NC1CCCC1
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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 C20H24BrN5O2S MW 478.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24BrN5O2S/c1-2-11-26-17(12-22-19(28)15-9-5-6-10-16(15)21)24-25-20(26)29-13-18(27)23-14-7-3-4-8-14/h2,5-6,9-10,14H,1,3-4,7-8,11-13H2,(H,22,28)(H,23,27)InChIKey
LXLZDNXIWZKJLM-UHFFFAOYSA-NSynonyms
2BROMON((5((2(CYCLOPENTYLAMINO)2OXOETHYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOL3YL)METHYL)BENZAMIDE
2bromoN((5(2(cyclopentylamino)2oxoethyl)sulfanyl4prop2enyl124triazol3yl)methyl)benzamide
C=CCN1C(=NN=C1SCC(=O)NC2CCCC2)CNC(=O)C3=CC=CC=C3Br
InChI=1SC20H24BrN5O2Sc12112617(122219(28)159561016(15)21)242520(26)291318(27)2314734814h25691014H134781113H2(H2228)(H2327)
MFCD08670341
N(4ALLYL5CYCLOPENTYLCARBAMOYLMETHYLSULFANYL4H(124)TRIAZOL3YLMETHYL)2BROMOBENZAMIDE
ZINC000009327814
ZINC09327814
ZINC9327814
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