Vitas-M small molecule compound

(2-chlorophenyl){4-[2-(morpholin-4-ylsulfonyl)-4-nitrophenyl]piperazin-1-yl}methanone

Catalog ID
STK067271
SMILES [O-][N+](=O)c1ccc(c(c1)S(=O)(=O)N1CCOCC1)N1CCN(CC1)C(=O)c1ccccc1Cl

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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 C21H23ClN4O6S MW 494.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClN4O6S/c22-18-4-2-1-3-17(18)21(27)24-9-7-23(8-10-24)19-6-5-16(26(28)29)15-20(19)33(30,31)25-11-13-32-14-12-25/h1-6,15H,7-14H2
InChIKey
VTGJMYBVFPNDGT-UHFFFAOYSA-N
Synonyms

(2CHLOROPHENYL)(4(2(MORPHOLIN4YLSULFONYL)4NITROPHENYL)PIPERAZIN1YL)METHANONE
(2chlorophenyl)(4(2(morpholinosulfonyl)4nitrophenyl)piperazin1yl)methanone
(2CHLOROPHENYL)(4(2MORPHOLIN4YLSULFONYL4NITROPHENYL)PIPERAZIN1YL)METHANONE
(O)(N+)(=O)c1ccc(c(c1)S(=O)(=O)N1CCOCC1)N1CCN(CC1)C(=O)c1ccccc1Cl
2CHLOROPHENYL4(2(MORPHOLIN4YLSULFONYL)4NITROPHENYL)PIPERAZINYLKETONE
C1CN(CCN1C2=C(C=C(C=C2)(N+)(=O)(O))S(=O)(=O)N3CCOCC3)C(=O)C4=CC=CC=C4Cl
InChI=1SC21H23ClN4O6Sc2218421317(18)21(27)249723(81024)196516(26(28)29)1520(19)33(3031)25111332141225h1615H714H2
MFCD02222096
STK067271
ZINC000004089482
ZINC04089482
ZINC4089482

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.