Vitas-M small molecule compound
2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-{2-[(4-nitrobenzyl)oxy]phenyl}methylidene]acetohydrazide
Catalog ID
STL047850
SMILES O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)Cl)N/N=C/c1ccccc1OCc1ccc(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 C30H23ClN6O4S MW 599.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23ClN6O4S/c31-24-14-12-22(13-15-24)29-34-35-30(36(29)25-7-2-1-3-8-25)42-20-28(38)33-32-18-23-6-4-5-9-27(23)41-19-21-10-16-26(17-11-21)37(39)40/h1-18H,19-20H2,(H,33,38)/b32-18+InChIKey
JMRNRFQIWMPEMN-KCSSXMTESA-NSynonyms
(E)2((5(4chlorophenyl)4phenyl4H124triazol3yl)thio)N(2((4nitrobenzyl)oxy)benzylidene)acetohydrazide
2((5(4chlorophenyl)4phenyl124triazol3yl)sulfanyl)N((E)(2((4nitrophenyl)methoxy)phenyl)methylideneamino)acetamide
2((5(4chlorophenyl)4phenyl4H124triazol3yl)sulfanyl)N((E)(2((4nitrobenzyl)oxy)phenyl)methylidene)acetohydrazide
C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC=CC=C3OCC4=CC=C(C=C4)(N+)(=O)(O))C5=CC=C(C=C5)Cl
InChI=1SC30H23ClN6O4Sc3124141222(131524)29343530(36(29)257213825)422028(38)33321823645927(23)411921101626(171121)37(39)40h118H1920H2(H3338)b3218+
MFCD02864499
O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)Cl)NN=Cc1ccccc1OCc1ccc(cc1)(N+)(=O)(O)
ZINC000001864678
ZINC103114641
Check stock
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Check stock on Vitas-MAvailable files
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