Vitas-M small molecule compound
(5Z)-2-(3-chlorophenyl)-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK800450
SMILES Clc1cccc(c1)c1nn2c(n1)s/c(=C\c1ccc(o1)c1cccc(c1)[N+](=O)[O-])/c2=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 C21H11ClN4O4S MW 450.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H11ClN4O4S/c22-14-5-1-4-13(9-14)19-23-21-25(24-19)20(27)18(31-21)11-16-7-8-17(30-16)12-3-2-6-15(10-12)26(28)29/h1-11H/b18-11-InChIKey
AHWUCQJWESBORU-WQRHYEAKSA-NSynonyms
587002-08-2(5Z)2(3chlorophenyl)5((5(3nitrophenyl)furan2yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2(3CHLOROPHENYL)5((5(3NITROPHENYL)FURAN2YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)2(3chlorophenyl)5((5(3nitrophenyl)furan2yl)methylene)thiazolo(32b)(124)triazol6(5H)one
587002082
C1=CC(=CC(=C1)(N+)(=O)(O))C2=CC=C(O2)C=C3C(=O)N4C(=NC(=N4)C5=CC(=CC=C5)Cl)S3
Clc1cccc(c1)c1nn2c(n1)sc(=Cc1ccc(o1)c1cccc(c1)(N+)(=O)(O))c2=O
InChI=1SC21H11ClN4O4Sc221451413(914)19232125(2419)20(27)18(3121)11167817(3016)1232615(1012)26(28)29h111Hb1811
MFCD04032255
ZINC000013757646
ZINC13757646
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