Vitas-M small molecule compound

2-(5-{4-[(3,4-dichlorophenyl)sulfonyl]piperazin-1-yl}-2-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline

Catalog ID
STK056271
SMILES [O-][N+](=O)c1ccc(cc1N1CCc2c(C1)cccc2)N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)Cl)Cl

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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 C25H24Cl2N4O4S MW 547.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24Cl2N4O4S/c26-22-7-6-21(16-23(22)27)36(34,35)30-13-11-28(12-14-30)20-5-8-24(31(32)33)25(15-20)29-10-9-18-3-1-2-4-19(18)17-29/h1-8,15-16H,9-14,17H2
InChIKey
ZROANIZULARNCM-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1ccc(cc1N1CCc2c(C1)cccc2)N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)Cl)Cl
2(5(4((34dichlorophenyl)sulfonyl)piperazin1yl)2nitrophenyl)1234tetrahydroisoquinoline
2(5(4(34DICHLOROPHENYL)SULFONYLPIPERAZIN1YL)2NITROPHENYL)34DIHYDRO1HISOQUINOLINE
C1CN(CC2=CC=CC=C21)C3=C(C=CC(=C3)N4CCN(CC4)S(=O)(=O)C5=CC(=C(C=C5)Cl)Cl)(N+)(=O)(O)
InChI=1SC25H24Cl2N4O4Sc26227621(1623(22)27)36(3435)30131128(121430)205824(31(32)33)25(1520)2910918312419(18)1729h181516H91417H2
MFCD03614867
STK056271
ZINC000100309311
ZINC100309311

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Available files

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