Vitas-M small molecule compound
N-[3-methyl-1-(4-methyl-5-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)butyl]thiophene-2-carboxamide
Catalog ID
STL196827
SMILES CC(CC(c1nnc(n1C)SCC(=O)N1CCN(CC1)c1ccccc1)NC(=O)c1cccs1)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 C25H32N6O2S2 MW 512.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N6O2S2/c1-18(2)16-20(26-24(33)21-10-7-15-34-21)23-27-28-25(29(23)3)35-17-22(32)31-13-11-30(12-14-31)19-8-5-4-6-9-19/h4-10,15,18,20H,11-14,16-17H2,1-3H3,(H,26,33)InChIKey
DWNDHQHGEDTLTB-UHFFFAOYSA-NSynonyms
CC(C)CC(C1=NN=C(N1C)SCC(=O)N2CCN(CC2)C3=CC=CC=C3)NC(=O)C4=CC=CS4
InChI=1SC25H32N6O2S2c118(2)1620(2624(33)21107153421)23272825(29(23)3)351722(32)31131130(121431)198546919h410151820H11141617H213H3(H2633)
MFCD17011029
N(3methyl1(4methyl5((2oxo2(4phenylpiperazin1yl)ethyl)sulfanyl)4H124triazol3yl)butyl)thiophene2carboxamide
N(3methyl1(4methyl5(2oxo2(4phenylpiperazin1yl)ethyl)sulfanyl124triazol3yl)butyl)thiophene2carboxamide
ZINC000038536860
ZINC000038536861
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