Vitas-M small molecule compound
4-(1,3-benzoxazol-2-ylsulfanyl)-3-nitrobenzonitrile
Catalog ID
STL061746
SMILES N#Cc1ccc(c(c1)[N+](=O)[O-])Sc1nc2c(o1)cccc2
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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 C14H7N3O3S MW 297.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H7N3O3S/c15-8-9-5-6-13(11(7-9)17(18)19)21-14-16-10-3-1-2-4-12(10)20-14/h1-7HInChIKey
AAMBIVWDDAAYHM-UHFFFAOYSA-NSynonyms
309281-73-0309281730
4(13benzoxazol2ylsulfanyl)3nitrobenzonitrile
4(benzo(d)oxazol2ylthio)3nitrobenzonitrile
4BENZOXAZOL2YLTHIO3NITROBENZENECARBONITRILE
C1=CC=C2C(=C1)N=C(O2)SC3=C(C=C(C=C3)C#N)(N+)(=O)(O)
InChI=1SC14H7N3O3Sc15895613(11(79)17(18)19)21141610312412(10)2014h17H
MFCD01820556
N#Cc1ccc(c(c1)(N+)(=O)(O))Sc1nc2c(o1)cccc2
ZINC000000209536
ZINC00209536
ZINC209536
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