Vitas-M small molecule compound
1-[4-(3-chlorophenyl)piperazin-1-yl]-2-{[5-(4-nitrophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK154180
SMILES Clc1cccc(c1)N1CCN(CC1)C(=O)CSc1nnc(n1c1ccccc1)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/c27-20-5-4-8-23(17-20)30-13-15-31(16-14-30)24(34)18-37-26-29-28-25(32(26)21-6-2-1-3-7-21)19-9-11-22(12-10-19)33(35)36/h1-12,17H,13-16,18H2InChIKey
HENBWZXEMWKEEL-UHFFFAOYSA-NSynonyms
1(4(3CHLOROPHENYL)PIPERAZIN1YL)2((5(4NITROPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)ETHANONE
1(4(3CHLOROPHENYL)PIPERAZIN1YL)2((5(4NITROPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)ETHANONE
C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=C(C=C5)(N+)(=O)(O)
Clc1cccc(c1)N1CCN(CC1)C(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC26H23ClN6O3Sc272054823(1720)30131531(161430)24(34)183726292825(32(26)216213721)1991122(121019)33(35)36h11217H131618H2
MFCD03870421
ZINC000059595736
ZINC59595736
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