Vitas-M small molecule compound
N-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-1-[(1,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-3-carboxamide
Catalog ID
STK313737
SMILES O=C(C1CCCN(C1)S(=O)(=O)c1cnn(c1C)C)NCCn1nc(c(c1C)[N+](=O)[O-])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 C18H27N7O5S MW 453.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H27N7O5S/c1-12-17(25(27)28)14(3)24(21-12)9-7-19-18(26)15-6-5-8-23(11-15)31(29,30)16-10-20-22(4)13(16)2/h10,15H,5-9,11H2,1-4H3,(H,19,26)InChIKey
SJTYTWSQVKBHSH-UHFFFAOYSA-NSynonyms
1005671-82-81005671828
CC1=C(C=NN1C)S(=O)(=O)N2CCCC(C2)C(=O)NCCN3C(=C(C(=N3)C)(N+)(=O)(O))C
InChI=1SC18H27N7O5Sc11217(25(27)28)14(3)24(2112)971918(26)1565823(1115)31(2930)16102022(4)13(16)2h1015H5911H214H3(H1926)
MFCD05667426
N(2(35dimethyl4nitro1Hpyrazol1yl)ethyl)1((15dimethyl1Hpyrazol4yl)sulfonyl)piperidine3carboxamide
N(2(35dimethyl4nitropyrazol1yl)ethyl)1(15dimethylpyrazol4yl)sulfonylpiperidine3carboxamide
O=C(C1CCCN(C1)S(=O)(=O)c1cnn(c1C)C)NCCn1nc(c(c1C)(N+)(=O)(O))C
ZINC000002733001
ZINC000002733002
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