Vitas-M small molecule compound
4-bromo-N-({4-ethyl-5-[(2-oxo-2-{[2-(propan-2-yl)phenyl]amino}ethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}methyl)benzamide
Catalog ID
STK140077
SMILES CCn1c(CNC(=O)c2ccc(cc2)Br)nnc1SCC(=O)Nc1ccccc1C(C)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 C23H26BrN5O2S MW 516.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26BrN5O2S/c1-4-29-20(13-25-22(31)16-9-11-17(24)12-10-16)27-28-23(29)32-14-21(30)26-19-8-6-5-7-18(19)15(2)3/h5-12,15H,4,13-14H2,1-3H3,(H,25,31)(H,26,30)InChIKey
PGLPRRZEMMIVMM-UHFFFAOYSA-NSynonyms
4BROMON((4ETHYL5((2OXO2((2(PROPAN2YL)PHENYL)AMINO)ETHYL)SULFANYL)4H124TRIAZOL3YL)METHYL)BENZAMIDE
4BROMON((4ETHYL5(2OXO2(2PROPAN2YLANILINO)ETHYL)SULFANYL124TRIAZOL3YL)METHYL)BENZAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2C(C)C)CNC(=O)C3=CC=C(C=C3)Br
InChI=1SC23H26BrN5O2Sc142920(132522(31)1691117(24)121016)272823(29)321421(30)2619865718(19)15(2)3h51215H41314H213H3(H2531)(H2630)
MFCD05986568
ZINC000002843773
ZINC02843773
ZINC2843773
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