Vitas-M small molecule compound
N-({5-[(2-{[4-bromo-2-(propan-2-yl)phenyl]amino}-2-oxoethyl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}methyl)-3,4-dimethoxybenzamide
Catalog ID
STK115492
SMILES CCn1c(CNC(=O)c2ccc(c(c2)OC)OC)nnc1SCC(=O)Nc1ccc(cc1C(C)C)Br
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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 C25H30BrN5O4S MW 576.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30BrN5O4S/c1-6-31-22(13-27-24(33)16-7-10-20(34-4)21(11-16)35-5)29-30-25(31)36-14-23(32)28-19-9-8-17(26)12-18(19)15(2)3/h7-12,15H,6,13-14H2,1-5H3,(H,27,33)(H,28,32)InChIKey
GUSDNAMRRFXBGT-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)Br)C(C)C)CNC(=O)C3=CC(=C(C=C3)OC)OC
InChI=1SC25H30BrN5O4Sc163122(132724(33)1671020(344)21(1116)355)293025(31)361423(32)28199817(26)1218(19)15(2)3h71215H61314H215H3(H2733)(H2832)
MFCD04127869
N((5((2((4BROMO2(PROPAN2YL)PHENYL)AMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)METHYL)34DIMETHOXYBENZAMIDE
N((5(2(4BROMO2PROPAN2YLANILINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)METHYL)34DIMETHOXYBENZAMIDE
ZINC000059749733
ZINC59749733
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