Vitas-M small molecule compound
2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanone
Catalog ID
STK392132
SMILES Clc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]
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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 C26H23ClN6O3S MW 535.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN6O3S/c27-20-8-6-19(7-9-20)25-28-29-26(32(25)22-4-2-1-3-5-22)37-18-24(34)31-16-14-30(15-17-31)21-10-12-23(13-11-21)33(35)36/h1-13H,14-18H2InChIKey
ZDJAXUAAMMQKCR-UHFFFAOYSA-NSynonyms
2((5(4CHLOROPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)1(4(4NITROPHENYL)PIPERAZIN1YL)ETHANONE
2((5(4chlorophenyl)4phenyl4H124triazol3yl)sulfanyl)1(4(4nitrophenyl)piperazin1yl)ethanone
2(5(4CHLOROPHENYL)4PHENYL(124TRIAZOL3YLTHIO))1(4(4NITROPHENYL)PIPERAZINYL)ETHAN1ONE
C1CN(CCN1C2=CC=C(C=C2)(N+)(=O)(O))C(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=C(C=C5)Cl
Clc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC26H23ClN6O3Sc27208619(7920)25282926(32(25)224213522)371824(34)31161430(151731)21101223(131121)33(35)36h113H1418H2
MFCD01809860
ZINC000004089457
ZINC4089457
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