Vitas-M small molecule compound

N-[2-(3,4-dimethylphenyl)-2H-benzotriazol-5-yl]-3-nitrobenzamide

Catalog ID
STK699976
SMILES O=C(c1cccc(c1)[N+](=O)[O-])Nc1ccc2c(c1)nn(n2)c1ccc(c(c1)C)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 C21H17N5O3 MW 387.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N5O3/c1-13-6-8-17(10-14(13)2)25-23-19-9-7-16(12-20(19)24-25)22-21(27)15-4-3-5-18(11-15)26(28)29/h3-12H,1-2H3,(H,22,27)
InChIKey
UFMQPUKRDMJFSI-UHFFFAOYSA-N
Synonyms
312633-44-6
312633446
CC1=C(C=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC(=CC=C4)(N+)(=O)(O))C
InChI=1SC21H17N5O3c1136817(1014(13)2)2523199716(1220(19)2425)2221(27)1543518(1115)26(28)29h312H12H3(H2227)
MFCD01064045
N(2(34dimethylphenyl)2Hbenzo(d)(123)triazol5yl)3nitrobenzamide
N(2(34dimethylphenyl)2Hbenzotriazol5yl)3nitrobenzamide
N(2(34DIMETHYLPHENYL)BENZOTRIAZOL5YL)3NITROBENZAMIDE
O=C(c1cccc(c1)(N+)(=O)(O))Nc1ccc2c(c1)nn(n2)c1ccc(c(c1)C)C
ZINC000001304094
ZINC01304094
ZINC1304094

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Available files

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