Vitas-M small molecule compound

N-[2-methyl-1-(2-methylpropanoyl)-1,2,3,4-tetrahydroquinolin-4-yl]-N-(4-nitrophenyl)benzamide

Catalog ID
STK870992
SMILES CC(C(=O)N1C(C)CC(c2c1cccc2)N(C(=O)c1ccccc1)c1ccc(cc1)[N+](=O)[O-])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 C27H27N3O4 MW 457.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O4/c1-18(2)26(31)28-19(3)17-25(23-11-7-8-12-24(23)28)29(27(32)20-9-5-4-6-10-20)21-13-15-22(16-14-21)30(33)34/h4-16,18-19,25H,17H2,1-3H3
InChIKey
YEHSVVFJTJUQOG-UHFFFAOYSA-N
Synonyms
331870-56-5
331870565
CC(C(=O)N1C(C)CC(c2c1cccc2)N(C(=O)c1ccccc1)c1ccc(cc1)(N+)(=O)(O))C
CC1CC(C2=CC=CC=C2N1C(=O)C(C)C)N(C3=CC=C(C=C3)(N+)(=O)(O))C(=O)C4=CC=CC=C4
InChI=1SC27H27N3O4c118(2)26(31)2819(3)1725(2311781224(23)28)29(27(32)2095461020)21131522(161421)30(33)34h416181925H17H213H3
MFCD01068110
N(1isobutyryl2methyl1234tetrahydroquinolin4yl)N(4nitrophenyl)benzamide
N(2methyl1(2methylpropanoyl)1234tetrahydroquinolin4yl)N(4nitrophenyl)benzamide
N(2METHYL1(2METHYLPROPANOYL)34DIHYDRO2HQUINOLIN4YL)N(4NITROPHENYL)BENZAMIDE
ZINC000008989884
ZINC000009186788

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Available files

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