Vitas-M small molecule compound
N-(2-{[3-(1H-imidazol-1-yl)propyl]carbamoyl}phenyl)-3-methyl-4-nitrobenzamide
Catalog ID
STK337555
SMILES O=C(c1ccccc1NC(=O)c1ccc(c(c1)C)[N+](=O)[O-])NCCCn1cncc1
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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 C21H21N5O4 MW 407.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O4/c1-15-13-16(7-8-19(15)26(29)30)20(27)24-18-6-3-2-5-17(18)21(28)23-9-4-11-25-12-10-22-14-25/h2-3,5-8,10,12-14H,4,9,11H2,1H3,(H,23,28)(H,24,27)InChIKey
ZCHLGXBVNNOOJF-UHFFFAOYSA-NSynonyms
CC1=C(C=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)NCCCN3C=CN=C3)(N+)(=O)(O)
InChI=1SC21H21N5O4c1151316(7819(15)26(29)30)20(27)2418632517(18)21(28)239411251210221425h2358101214H4911H21H3(H2328)(H2427)
MFCD09185617
N(2((3(1Himidazol1yl)propyl)carbamoyl)phenyl)3methyl4nitrobenzamide
N(2(3imidazol1ylpropylcarbamoyl)phenyl)3methyl4nitrobenzamide
O=C(c1ccccc1NC(=O)c1ccc(c(c1)C)(N+)(=O)(O))NCCCn1cncc1
ZINC000010313204
ZINC10313204
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