Vitas-M small molecule compound
[5-(2-chlorophenyl)furan-2-yl][4-(4-nitrophenyl)piperazin-1-yl]methanethione
Catalog ID
STL069591
SMILES S=C(c1ccc(o1)c1ccccc1Cl)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 C21H18ClN3O3S MW 427.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O3S/c22-18-4-2-1-3-17(18)19-9-10-20(28-19)21(29)24-13-11-23(12-14-24)15-5-7-16(8-6-15)25(26)27/h1-10H,11-14H2InChIKey
UJZTVMYYTRHVOU-UHFFFAOYSA-NSynonyms
459196-37-3(5(2chlorophenyl)furan2yl)(4(4nitrophenyl)piperazin1yl)methanethione
459196373
C1CN(CCN1C2=CC=C(C=C2)(N+)(=O)(O))C(=S)C3=CC=C(O3)C4=CC=CC=C4Cl
InChI=1SC21H18ClN3O3Sc2218421317(18)1991020(2819)21(29)24131123(121424)155716(8615)25(26)27h110H1114H2
MFCD02977141
S=C(c1ccc(o1)c1ccccc1Cl)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
ZINC000009009403
ZINC09009403
ZINC9009403
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