Vitas-M small molecule compound

3-[(3-chlorobenzyl)sulfanyl]-4-methyl-5-[(2-methyl-5-nitro-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazole

Catalog ID
STK743985
SMILES Clc1cccc(c1)CSc1nnc(n1C)Cn1c(C)ncc1[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 C15H15ClN6O2S MW 378.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15ClN6O2S/c1-10-17-7-14(22(23)24)21(10)8-13-18-19-15(20(13)2)25-9-11-4-3-5-12(16)6-11/h3-7H,8-9H2,1-2H3
InChIKey
QRWFWVGCNZWIMD-UHFFFAOYSA-N
Synonyms
728024-18-8
3((3chlorobenzyl)sulfanyl)4methyl5((2methyl5nitro1Himidazol1yl)methyl)4H124triazole
3((3chlorobenzyl)thio)4methyl5((2methyl5nitro1Himidazol1yl)methyl)4H124triazole
3((3CHLOROPHENYL)METHYLSULFANYL)4METHYL5((2METHYL5NITROIMIDAZOL1YL)METHYL)124TRIAZOLE
728024188
CC1=NC=C(N1CC2=NN=C(N2C)SCC3=CC(=CC=C3)Cl)(N+)(=O)(O)
Clc1cccc(c1)CSc1nnc(n1C)Cn1c(C)ncc1(N+)(=O)(O)
InChI=1SC15H15ClN6O2Sc11017714(22(23)24)21(10)813181915(20(13)2)2591143512(16)611h37H89H212H3
MFCD06016139
ZINC000004386111
ZINC04386111
ZINC4386111

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Available files

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