Vitas-M small molecule compound

N'-{2-[(3-bromobenzyl)oxy]benzylidene}-2-{[5-{[(4-iodophenyl)amino]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

Catalog ID
STL172724
SMILES C=CCn1c(SCC(=O)N/N=C/c2ccccc2OCc2cccc(c2)Br)nnc1CNc1ccc(cc1)I

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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 C28H26BrIN6O2S MW 717.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26BrIN6O2S/c1-2-14-36-26(17-31-24-12-10-23(30)11-13-24)33-35-28(36)39-19-27(37)34-32-16-21-7-3-4-9-25(21)38-18-20-6-5-8-22(29)15-20/h2-13,15-16,31H,1,14,17-19H2,(H,34,37)
InChIKey
BPHQMRCZEFEXLA-UHFFFAOYSA-N
Synonyms
438615-55-5
2((4ALLYL5((4IODOANILINO)METHYL)4H124TRIAZOL3YL)SULFANYL)N(2((3BROMOBENZYL)OXY)BENZYLIDENE)ACETOHYDRAZIDE
438615555
C=CCN1C(=NN=C1SCC(=O)NN=CC2=CC=CC=C2OCC3=CC(=CC=C3)Br)CNC4=CC=C(C=C4)I
C=CCn1c(SCC(=O)NN=Cc2ccccc2OCc2cccc(c2)Br)nnc1CNc1ccc(cc1)I
InChI=1SC28H26BrIN6O2Sc12143626(173124121023(30)111324)333528(36)391927(37)34321621734925(21)38182065822(29)1520h213151631H1141719H2(H3437)
MFCD01436399
N((2((3BROMOPHENYL)METHOXY)PHENYL)METHYLIDENEAMINO)2((5((4IODOANILINO)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2((3bromobenzyl)oxy)benzylidene)2((5(((4iodophenyl)amino)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetohydrazide
ZINC000245238845

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Available files

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