Vitas-M small molecule compound
2-chloro-N-{3-methyl-1-[4-methyl-5-({2-oxo-2-[(2-phenylethyl)amino]ethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]butyl}benzamide
Catalog ID
STL138476
SMILES O=C(CSc1nnc(n1C)C(NC(=O)c1ccccc1Cl)CC(C)C)NCCc1ccccc1
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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 C25H30ClN5O2S MW 500.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30ClN5O2S/c1-17(2)15-21(28-24(33)19-11-7-8-12-20(19)26)23-29-30-25(31(23)3)34-16-22(32)27-14-13-18-9-5-4-6-10-18/h4-12,17,21H,13-16H2,1-3H3,(H,27,32)(H,28,33)InChIKey
JYRXGKGUVYPTMX-UHFFFAOYSA-NSynonyms
2chloroN(3methyl1(4methyl5((2oxo2((2phenylethyl)amino)ethyl)sulfanyl)4H124triazol3yl)butyl)benzamide
2chloroN(3methyl1(4methyl5(2oxo2(2phenylethylamino)ethyl)sulfanyl124triazol3yl)butyl)benzamide
2CHLORON(3METHYL1(4METHYL5(2OXO2(PHENETHYLAMINO)ETHYL)SULFANYL124TRIAZOL3YL)BUTYL)BENZAMIDE
CC(C)CC(C1=NN=C(N1C)SCC(=O)NCCC2=CC=CC=C2)NC(=O)C3=CC=CC=C3Cl
InChI=1SC25H30ClN5O2Sc117(2)1521(2824(33)1911781220(19)26)23293025(31(23)3)341622(32)2714131895461018h4121721H1316H213H3(H2732)(H2833)
MFCD05992014
ZINC000012382170
ZINC000012382171
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