Vitas-M small molecule compound

4-(5-{4-[(4-methylphenyl)sulfonyl]piperazin-1-yl}-2-nitrophenyl)morpholine

Catalog ID
STK148724
SMILES Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)N1CCOCC1)[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 C21H26N4O5S MW 446.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O5S/c1-17-2-5-19(6-3-17)31(28,29)24-10-8-22(9-11-24)18-4-7-20(25(26)27)21(16-18)23-12-14-30-15-13-23/h2-7,16H,8-15H2,1H3
InChIKey
OCSHZEOHKHLLEZ-UHFFFAOYSA-N
Synonyms

1((4METHYLPHENYL)SULFONYL)4(3MORPHOLIN4YL4NITROPHENYL)PIPERAZINE
4(2NITRO5(4(TOLUENE4SULFONYL)PIPERAZIN1YL)PHENYL)MORPHOLINE
4(5(4((4METHYLPHENYL)SULFONYL)PIPERAZIN1YL)2NITROPHENYL)MORPHOLINE
4(5(4(4METHYLPHENYL)SULFONYLPIPERAZIN1YL)2NITROPHENYL)MORPHOLINE
CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))N4CCOCC4
Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)N1CCOCC1)(N+)(=O)(O)
InChI=1SC21H26N4O5Sc1172519(6317)31(2829)2410822(91124)184720(25(26)27)21(1618)23121430151323h2716H815H21H3
MFCD02218766
ZINC000009601703
ZINC09601703
ZINC9601703

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Available files

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