Vitas-M small molecule compound
3-[(4-nitrobenzyl)sulfanyl]-5-phenyl-4H-1,2,4-triazol-4-amine
Catalog ID
STL070653
SMILES Nn1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1ccccc1
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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 C15H13N5O2S MW 327.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N5O2S/c16-19-14(12-4-2-1-3-5-12)17-18-15(19)23-10-11-6-8-13(9-7-11)20(21)22/h1-9H,10,16H2InChIKey
UDUQMDIOQUYIGQ-UHFFFAOYSA-NSynonyms
577787-06-53((4nitrobenzyl)sulfanyl)5phenyl4H124triazol4amine
3((4nitrobenzyl)thio)5phenyl4H124triazol4amine
3((4NITROPHENYL)METHYLSULFANYL)5PHENYL124TRIAZOL4AMINE
3((4NITROPHENYL)METHYLTHIO)5PHENYL124TRIAZOLE4YLAMINE
577787065
C1=CC=C(C=C1)C2=NN=C(N2N)SCC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC15H13N5O2Sc161914(124213512)171815(19)2310116813(9711)20(21)22h19H1016H2
MFCD04026978
ZINC000000531676
ZINC00531676
ZINC531676
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