Vitas-M small molecule compound
N-(1-methyl-5-{[(1-methyl-1H-pyrazol-4-yl)methyl]carbamoyl}-1H-pyrazol-4-yl)-1-[(1-methyl-1H-pyrazol-4-yl)sulfonyl]piperidine-3-carboxamide
Catalog ID
STL394128
SMILES Cn1ncc(c1)CNC(=O)c1c(cnn1C)NC(=O)C1CCCN(C1)S(=O)(=O)c1cnn(c1)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 C20H27N9O4S MW 489.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N9O4S/c1-26-11-14(8-22-26)7-21-20(31)18-17(10-24-28(18)3)25-19(30)15-5-4-6-29(12-15)34(32,33)16-9-23-27(2)13-16/h8-11,13,15H,4-7,12H2,1-3H3,(H,21,31)(H,25,30)InChIKey
PCOKPTDDLOTWLZ-UHFFFAOYSA-NSynonyms
1005618-82-51005618825
CN1C=C(C=N1)CNC(=O)C2=C(C=NN2C)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CN(N=C4)C
InChI=1SC20H27N9O4Sc1261114(82226)72120(31)1817(102428(18)3)2519(30)1554629(1215)34(3233)1692327(2)1316h8111315H4712H213H3(H2131)(H2530)
MFCD04136268
N(1METHYL5(((1METHYL1HPYRAZOL4YL)METHYL)CARBAMOYL)1HPYRAZOL4YL)1((1METHYL1HPYRAZOL4YL)SULFONYL)PIPERIDINE3CARBOXAMIDE
N(1methyl5((1methylpyrazol4yl)methylcarbamoyl)pyrazol4yl)1(1methylpyrazol4yl)sulfonylpiperidine3carboxamide
ZINC000002806287
ZINC000002806288
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