Vitas-M small molecule compound

4-{4-[(3-methylphenyl)carbonyl]piperazin-1-yl}-3-nitro-N-(tricyclo[3.3.1.1~3,7~]dec-2-yl)benzamide

Catalog ID
STK157817
SMILES Cc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(=O)NC1C2CC3CC1CC(C2)C3

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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 C29H34N4O4 MW 502.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N4O4/c1-18-3-2-4-22(11-18)29(35)32-9-7-31(8-10-32)25-6-5-21(17-26(25)33(36)37)28(34)30-27-23-13-19-12-20(15-23)16-24(27)14-19/h2-6,11,17,19-20,23-24,27H,7-10,12-16H2,1H3,(H,30,34)
InChIKey
AMPVGELTKDRWHS-UHFFFAOYSA-N
Synonyms
956263-92-6
4(4((3methylphenyl)carbonyl)piperazin1yl)3nitroN(tricyclo(3311~37~)dec2yl)benzamide
956263926
CC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4C5CC6CC(C5)CC4C6)(N+)(=O)(O)
Cc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(cc1(N+)(=O)(O))C(=O)NC1C2CC3CC1CC(C2)C3
InChI=1SC29H34N4O4c11832422(1118)29(35)329731(81032)256521(1726(25)33(36)37)28(34)30272313191220(1523)1624(27)1419h2611171920232427H7101216H21H3(H3034)
MFCD03690269
N((1r3r5r7r)adamantan2yl)4(4(3methylbenzoyl)piperazin1yl)3nitrobenzamide
N(2ADAMANTYL)4(4(3METHYLBENZOYL)PIPERAZIN1YL)3NITROBENZAMIDE
ZINC000009008960
ZINC09008960
ZINC9008960

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Available files

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