Vitas-M small molecule compound

N-{3-[bis(2-methylpropyl)amino]-2-hydroxypropyl}-2-nitro-N-phenylbenzenesulfonamide

Catalog ID
STK553034
SMILES OC(CN(S(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1)CN(CC(C)C)CC(C)C

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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 C23H33N3O5S MW 463.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H33N3O5S/c1-18(2)14-24(15-19(3)4)16-21(27)17-25(20-10-6-5-7-11-20)32(30,31)23-13-9-8-12-22(23)26(28)29/h5-13,18-19,21,27H,14-17H2,1-4H3
InChIKey
PXIYBXVBWJIZLO-UHFFFAOYSA-N
Synonyms
400064-60-0
400064600
CC(C)CN(CC(C)C)CC(CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2(N+)(=O)(O))O
InChI=1SC23H33N3O5Sc118(2)1424(1519(3)4)1621(27)1725(20106571120)32(3031)2313981222(23)26(28)29h51318192127H1417H214H3
MFCD02928452
N((2S)3(BIS(2METHYLPROPYL)AMINO)2HYDROXYPROPYL)2NITRONPHENYLBENZENESULFONAMIDE
N(3(bis(2methylpropyl)amino)2hydroxypropyl)2nitroNphenylbenzenesulfonamide
N(3(diisobutylamino)2hydroxypropyl)2nitroNphenylbenzenesulfonamide
N(3DIISOBUTYLAMINO2HYDROXYPROPYL)2NITRONPHENYLBENZENESULFONAMIDE
OC(CN(S(=O)(=O)c1ccccc1(N+)(=O)(O))c1ccccc1)CN(CC(C)C)CC(C)C
ZINC000002205653
ZINC000002205654

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Available files

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