Vitas-M small molecule compound
2-({5-[1-(4-ethylphenoxy)ethyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(4-phenylpiperazin-1-yl)ethanone
Catalog ID
STK140139
SMILES CCc1ccc(cc1)OC(c1nnc(n1C)SCC(=O)N1CCN(CC1)c1ccccc1)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 C25H31N5O2S MW 465.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N5O2S/c1-4-20-10-12-22(13-11-20)32-19(2)24-26-27-25(28(24)3)33-18-23(31)30-16-14-29(15-17-30)21-8-6-5-7-9-21/h5-13,19H,4,14-18H2,1-3H3InChIKey
UUYIGANPAYCKFH-UHFFFAOYSA-NSynonyms
2((5(1(4ETHYLPHENOXY)ETHYL)4METHYL124TRIAZOL3YL)SULFANYL)1(4PHENYLPIPERAZIN1YL)ETHANONE
2((5(1(4ETHYLPHENOXY)ETHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)1(4PHENYLPIPERAZIN1YL)ETHANONE
CCC1=CC=C(C=C1)OC(C)C2=NN=C(N2C)SCC(=O)N3CCN(CC3)C4=CC=CC=C4
InChI=1SC25H31N5O2Sc1420101222(131120)3219(2)24262725(28(24)3)331823(31)30161429(151730)218657921h51319H41418H213H3
MFCD05992432
ZINC000009264635
ZINC000009264640
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