Vitas-M small molecule compound
N-{3-(benzylsulfanyl)-1-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-1-oxopropan-2-yl}-3,5-dinitrobenzamide (non-preferred name)
Catalog ID
STK669935
SMILES O=C(C(NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])CSCc1ccccc1)N/N=C/c1ccc(cc1)Cl
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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 C24H20ClN5O6S MW 541.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN5O6S/c25-19-8-6-16(7-9-19)13-26-28-24(32)22(15-37-14-17-4-2-1-3-5-17)27-23(31)18-10-20(29(33)34)12-21(11-18)30(35)36/h1-13,22H,14-15H2,(H,27,31)(H,28,32)/b26-13+InChIKey
PFBORTAOZVWJQX-LGJNPRDNSA-NSynonyms
C1=CC=C(C=C1)CSCC(C(=O)NN=CC2=CC=C(C=C2)Cl)NC(=O)C3=CC(=CC(=C3)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC24H20ClN5O6Sc25198616(7919)13262824(32)22(153714174213517)2723(31)181020(29(33)34)1221(1118)30(35)36h11322H1415H2(H2731)(H2832)b2613+
MFCD00470412
N(3(benzylsulfanyl)1((2E)2(4chlorobenzylidene)hydrazinyl)1oxopropan2yl)35dinitrobenzamide(nonpreferredname)
N(3benzylsulfanyl1((2E)2((4chlorophenyl)methylidene)hydrazinyl)1oxopropan2yl)35dinitrobenzamide
O=C(C(NC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O))CSCc1ccccc1)NN=Cc1ccc(cc1)Cl
ZINC000033354476
ZINC000033354478
Check stock
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Check stock on Vitas-MAvailable files
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