Vitas-M small molecule compound
1-{4-nitro-3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]phenyl}-4-(phenylsulfonyl)piperazine
Catalog ID
STK150369
SMILES [O-][N+](=O)c1ccc(cc1Sc1nnnn1c1ccccc1)N1CCN(CC1)S(=O)(=O)c1ccccc1
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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 C23H21N7O4S2 MW 523.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N7O4S2/c31-30(32)21-12-11-19(17-22(21)35-23-24-25-26-29(23)18-7-3-1-4-8-18)27-13-15-28(16-14-27)36(33,34)20-9-5-2-6-10-20/h1-12,17H,13-16H2InChIKey
BRYUBDNQEYMJEY-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1Sc1nnnn1c1ccccc1)N1CCN(CC1)S(=O)(=O)c1ccccc1
1(4NITRO3((1PHENYL1HTETRAZOL5YL)SULFANYL)PHENYL)4(PHENYLSULFONYL)PIPERAZINE
1(BENZENESULFONYL)4(4NITRO3(1PHENYLTETRAZOL5YL)SULFANYLPHENYL)PIPERAZINE
C1CN(CCN1C2=CC(=C(C=C2)(N+)(=O)(O))SC3=NN=NN3C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5
InChI=1SC23H21N7O4S2c3130(32)21121119(1722(21)352324252629(23)187314818)27131528(161427)36(3334)2095261020h11217H1316H2
MFCD03306479
ZINC000100310625
ZINC100310625
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