Vitas-M small molecule compound
1-{3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl}-4-(naphthalen-2-ylsulfonyl)piperazine
Catalog ID
STK171076
SMILES Cn1cnnc1Sc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)S(=O)(=O)c1ccc2c(c1)cccc2
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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 C23H22N6O4S2 MW 510.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N6O4S2/c1-26-16-24-25-23(26)34-22-15-19(7-9-21(22)29(30)31)27-10-12-28(13-11-27)35(32,33)20-8-6-17-4-2-3-5-18(17)14-20/h2-9,14-16H,10-13H2,1H3InChIKey
VQAXMFWLJOPZBJ-UHFFFAOYSA-NSynonyms
1(3((4METHYL124TRIAZOL3YL)SULFANYL)4NITROPHENYL)4NAPHTHALEN2YLSULFONYLPIPERAZINE
1(3((4METHYL4H124TRIAZOL3YL)SULFANYL)4NITROPHENYL)4(NAPHTHALEN2YLSULFONYL)PIPERAZINE
1(3((4METHYL4H124TRIAZOL3YL)THIO)4NITROPHENYL)4(2NAPHTHYLSULFONYL)PIPERAZINE
CN1C=NN=C1SC2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)(N+)(=O)(O)
Cn1cnnc1Sc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)S(=O)(=O)c1ccc2c(c1)cccc2
InChI=1SC23H22N6O4S2c12616242523(26)34221519(7921(22)29(30)31)27101228(131127)35(3233)208617423518(17)1420h291416H1013H21H3
MFCD04220431
ZINC000008682718
ZINC08682718
ZINC8682718
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