Vitas-M small molecule compound

N-{(E)-[1-(3-chloro-2-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-4H-1,2,4-triazol-4-amine

Catalog ID
STK196990
SMILES Clc1cccc(c1C)n1c(C)cc(c1C)/C=N/n1cnnc1

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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 C16H16ClN5 MW 313.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN5/c1-11-7-14(8-20-21-9-18-19-10-21)13(3)22(11)16-6-4-5-15(17)12(16)2/h4-10H,1-3H3/b20-8+
InChIKey
YORWTTDJHRLBHE-DNTJNYDQSA-N
Synonyms

(E)1(1(3chloro2methylphenyl)25dimethylpyrrol3yl)N(124triazol4yl)methanimine
1(1(3CHLORO2METHYLPHENYL)25DIMETHYLPYRROL3YL)N(124TRIAZOL4YL)METHANIMINE
4((1E)2(1(3CHLORO2METHYLPHENYL)25DIMETHYLPYRROL3YL)1AZAVINYL)124TRIAZOLE
CC1=CC(=C(N1C2=C(C(=CC=C2)Cl)C)C)C=NN3C=NN=C3
Clc1cccc(c1C)n1c(C)cc(c1C)C=Nn1cnnc1
InChI=1SC16H16ClN5c111714(82021918191021)13(3)22(11)1664515(17)12(16)2h410H13H3b208+
MFCD03729474
N((E)(1(3CHLORO2METHYLPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)4H124TRIAZOL4AMINE
ZINC000000037504
ZINC00037503
ZINC37503

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Available files

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