Vitas-M small molecule compound
2-chloro-N-[2-(cyclohexylcarbamoyl)phenyl]-5-nitrobenzamide
Catalog ID
STK258594
SMILES O=C(c1ccccc1NC(=O)c1cc(ccc1Cl)[N+](=O)[O-])NC1CCCCC1
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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 C20H20ClN3O4 MW 401.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN3O4/c21-17-11-10-14(24(27)28)12-16(17)20(26)23-18-9-5-4-8-15(18)19(25)22-13-6-2-1-3-7-13/h4-5,8-13H,1-3,6-7H2,(H,22,25)(H,23,26)InChIKey
QJDBJKNOFSXJIB-UHFFFAOYSA-NSynonyms
2chloroN(2(cyclohexylcarbamoyl)phenyl)5nitrobenzamide
C1CCC(CC1)NC(=O)C2=CC=CC=C2NC(=O)C3=C(C=CC(=C3)(N+)(=O)(O))Cl
InChI=1SC20H20ClN3O4c2117111014(24(27)28)1216(17)20(26)2318954815(18)19(25)22136213713h45813H1367H2(H2225)(H2326)
MFCD07150646
O=C(c1ccccc1NC(=O)c1cc(ccc1Cl)(N+)(=O)(O))NC1CCCCC1
ZINC000009425998
ZINC09425998
ZINC9425998
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