Vitas-M small molecule compound
3-{4-methyl-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}aniline
Catalog ID
STK868736
SMILES Nc1cccc(c1)c1nnc(n1C)SCc1ccc(cc1)[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 C16H15N5O2S MW 341.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N5O2S/c1-20-15(12-3-2-4-13(17)9-12)18-19-16(20)24-10-11-5-7-14(8-6-11)21(22)23/h2-9H,10,17H2,1H3InChIKey
QNWCOJGRASLRSK-UHFFFAOYSA-NSynonyms
433251-49-13(3AMINOPHENYL)5((4NITROBENZYL)SULFANYL)4METHYL4H124TRIAZOLE
3(4methyl5((4nitrobenzyl)sulfanyl)4H124triazol3yl)aniline
3(4methyl5((4nitrobenzyl)thio)4H124triazol3yl)aniline
3(4METHYL5((4NITROPHENYL)METHYLSULFANYL)124TRIAZOL3YL)ANILINE
433251491
CN1C(=NN=C1SCC2=CC=C(C=C2)(N+)(=O)(O))C3=CC(=CC=C3)N
InChI=1SC16H15N5O2Sc12015(1232413(17)912)181916(20)2410115714(8611)21(22)23h29H1017H21H3
MFCD03079917
Nc1cccc(c1)c1nnc(n1C)SCc1ccc(cc1)(N+)(=O)(O)
ZINC000000360966
ZINC00360966
ZINC360966
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