Vitas-M small molecule compound
5-(3-methoxyphenyl)-N-(octahydro-2H-quinolizin-1-ylmethyl)-1H-pyrazole-3-carboxamide
Catalog ID
STL473144
SMILES COc1cccc(c1)c1[nH]nc(c1)C(=O)NCC1CCCN2C1CCCC2
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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 C21H28N4O2 MW 368.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O2/c1-27-17-8-4-6-15(12-17)18-13-19(24-23-18)21(26)22-14-16-7-5-11-25-10-3-2-9-20(16)25/h4,6,8,12-13,16,20H,2-3,5,7,9-11,14H2,1H3,(H,22,26)(H,23,24)InChIKey
ZZFSKJIAKIBPSR-UHFFFAOYSA-NSynonyms
3(3methoxyphenyl)N(((1S9aR)octahydro1Hquinolizin1yl)methyl)1Hpyrazole5carboxamide
5(3methoxyphenyl)N(octahydro2Hquinolizin1ylmethyl)1Hpyrazole3carboxamide
COC1=CC=CC(=C1)C2=NNC(=C2)C(=O)NCC3CCCN4C3CCCC4
COc1cccc(c1)c1(nH)nc(c1)C(=O)NCC1CCCN2C1CCCC2
COc1cccc(c1)c1n(nH)c(c1)C(=O)NC(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC21H28N4O2c1271784615(1217)181319(242318)21(26)2214167511251032920(16)25h46812131620H235791114H21H3(H2226)(H2324)
MFCD27962549
N(23467899aoctahydro1Hquinolizin1ylmethyl)3(3methoxyphenyl)1Hpyrazole5carboxamide
ZINC000085878926
ZINC000169680659
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