Vitas-M small molecule compound

2-methyl-3-nitro-N-[(1,3,3-trimethyl-5-{[(2-methyl-3-nitrophenyl)carbonyl]amino}cyclohexyl)methyl]benzamide

Catalog ID
STK420710
SMILES O=C(c1cccc(c1C)[N+](=O)[O-])NCC1(C)CC(NC(=O)c2cccc(c2C)[N+](=O)[O-])CC(C1)(C)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 C26H32N4O6 MW 496.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N4O6/c1-16-19(8-6-10-21(16)29(33)34)23(31)27-15-26(5)13-18(12-25(3,4)14-26)28-24(32)20-9-7-11-22(17(20)2)30(35)36/h6-11,18H,12-15H2,1-5H3,(H,27,31)(H,28,32)
InChIKey
QJVRZRDCBHZSRU-UHFFFAOYSA-N
Synonyms

2methyl3nitroN((133trimethyl5(((2methyl3nitrophenyl)carbonyl)amino)cyclohexyl)methyl)benzamide
2METHYL3NITRON((133TRIMETHYL5((2METHYL3NITROBENZOYL)AMINO)CYCLOHEXYL)METHYL)BENZAMIDE
3NITRON((5((3NITRO2METHYLBENZOYL)AMINO)133TRIMETHYLCYCLOHEXYL)METHYL)2METHYLBENZAMIDE
CC1=C(C=CC=C1(N+)(=O)(O))C(=O)NCC2(CC(CC(C2)(C)C)NC(=O)C3=C(C(=CC=C3)(N+)(=O)(O))C)C
InChI=1SC26H32N4O6c11619(861021(16)29(33)34)23(31)271526(5)1318(1225(34)1426)2824(32)20971122(17(20)2)30(35)36h61118H1215H215H3(H2731)(H2832)
MFCD02054106
O=C(c1cccc(c1C)(N+)(=O)(O))NCC1(C)CC(NC(=O)c2cccc(c2C)(N+)(=O)(O))CC(C1)(C)C
ZINC000008443693
ZINC000008443696

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Available files

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