Vitas-M small molecule compound
3-(3-ethoxyphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazol-4-amine
Catalog ID
STL052067
SMILES CCOc1cccc(c1)c1nnc(n1N)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 C17H17N5O3S MW 371.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N5O3S/c1-2-25-15-5-3-4-13(10-15)16-19-20-17(21(16)18)26-11-12-6-8-14(9-7-12)22(23)24/h3-10H,2,11,18H2,1H3InChIKey
PVVPHLZEYVJMHK-UHFFFAOYSA-NSynonyms
577960-13-53(3ethoxyphenyl)5((4nitrobenzyl)sulfanyl)4H124triazol4amine
3(3ethoxyphenyl)5((4nitrobenzyl)thio)4H124triazol4amine
3(3ETHOXYPHENYL)5((4NITROPHENYL)METHYLSULFANYL)124TRIAZOL4AMINE
5(3ETHOXYPHENYL)3((4NITROPHENYL)METHYLTHIO)124TRIAZOLE4YLAMINE
577960135
CCOC1=CC=CC(=C1)C2=NN=C(N2N)SCC3=CC=C(C=C3)(N+)(=O)(O)
CCOc1cccc(c1)c1nnc(n1N)SCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC17H17N5O3Sc12251553413(1015)16192017(21(16)18)2611126814(9712)22(23)24h310H21118H21H3
MFCD04028507
ZINC000005093265
ZINC05093265
ZINC5093265
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