Vitas-M small molecule compound

N-(3,4-dimethylphenyl)-7-(3-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-amine

Catalog ID
STK834501
SMILES CC1CCCN(C1)c1cc(Nc2ccc(c(c2)C)C)c(c2c1non2)[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 C20H23N5O3 MW 381.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5O3/c1-12-5-4-8-24(11-12)17-10-16(21-15-7-6-13(2)14(3)9-15)20(25(26)27)19-18(17)22-28-23-19/h6-7,9-10,12,21H,4-5,8,11H2,1-3H3
InChIKey
CPMXZRIFIUEVFD-UHFFFAOYSA-N
Synonyms

CC1CCCN(C1)c1cc(Nc2ccc(c(c2)C)C)c(c2c1non2)(N+)(=O)(O)
CC1CCCN(C1)C2=CC(=C(C3=NON=C23)(N+)(=O)(O))NC4=CC(=C(C=C4)C)C
InChI=1SC20H23N5O3c11254824(1112)171016(21157613(2)14(3)915)20(25(26)27)1918(17)22282319h679101221H45811H213H3
MFCD02161665
N(34dimethylphenyl)7(3methylpiperidin1yl)4nitro213benzoxadiazol5amine
N(34dimethylphenyl)7(3methylpiperidin1yl)4nitrobenzo(c)(125)oxadiazol5amine
ZINC000004817228
ZINC000004817229

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Available files

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