Vitas-M small molecule compound

N-{2-[(4-chlorophenyl)carbamoyl]-4,6-dinitrophenyl}leucine

Catalog ID
STK673286
SMILES Clc1ccc(cc1)NC(=O)c1cc(cc(c1NC(C(=O)O)CC(C)C)[N+](=O)[O-])[N+](=O)[O-]

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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 C19H19ClN4O7 MW 450.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN4O7/c1-10(2)7-15(19(26)27)22-17-14(8-13(23(28)29)9-16(17)24(30)31)18(25)21-12-5-3-11(20)4-6-12/h3-6,8-10,15,22H,7H2,1-2H3,(H,21,25)(H,26,27)
InChIKey
FPYNJWMJOAMMBC-UHFFFAOYSA-N
Synonyms

2((6(N(4CHLOROPHENYL)CARBAMOYL)24DINITROPHENYL)AMINO)4METHYLPENTANOICACID
2(2((4CHLOROPHENYL)CARBAMOYL)46DINITROANILINO)4METHYLPENTANOICACID
CC(C)CC(C(=O)O)NC1=C(C=C(C=C1C(=O)NC2=CC=C(C=C2)Cl)(N+)(=O)(O))(N+)(=O)(O)
Clc1ccc(cc1)NC(=O)c1cc(cc(c1NC(C(=O)O)CC(C)C)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC19H19ClN4O7c110(2)715(19(26)27)221714(813(23(28)29)916(17)24(30)31)18(25)21125311(20)4612h368101522H7H212H3(H2125)(H2627)
MFCD01113753
N(2((4chlorophenyl)carbamoyl)46dinitrophenyl)leucine
ZINC000008809750
ZINC000008809751

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.