Vitas-M small molecule compound
3-{[1,5-bis(4-chlorophenyl)-1H-1,2,3-triazol-4-yl]carbonyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL448414
SMILES Clc1ccc(cc1)c1c(nnn1c1ccc(cc1)Cl)C(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1
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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 C26H21Cl2N5O2 MW 506.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21Cl2N5O2/c27-19-6-4-17(5-7-19)25-24(29-30-33(25)21-10-8-20(28)9-11-21)26(35)31-13-16-12-18(15-31)22-2-1-3-23(34)32(22)14-16/h1-11,16,18H,12-15H2InChIKey
LGACODOIBOEMCI-UHFFFAOYSA-NSynonyms
3((15bis(4chlorophenyl)1H123triazol4yl)carbonyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
C1C2CN(CC1C3=CC=CC(=O)N3C2)C(=O)C4=C(N(N=N4)C5=CC=C(C=C5)Cl)C6=CC=C(C=C6)Cl
InChI=1SC26H21Cl2N5O2c27196417(5719)2524(293033(25)2110820(28)91121)26(35)3113161218(1531)2221323(34)32(22)1416h1111618H1215H2
MFCD08273306
ZINC000008773616
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