Vitas-M small molecule compound

N'-[(1E)-1-(biphenyl-4-yl)ethylidene]-2-{[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

Catalog ID
STK090841
SMILES COc1cc(cc(c1OC)OC)c1nnc(n1c1ccccc1)SCC(=O)N/N=C(/c1ccc(cc1)c1ccccc1)\C

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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 C33H31N5O4S MW 593.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31N5O4S/c1-22(23-15-17-25(18-16-23)24-11-7-5-8-12-24)34-35-30(39)21-43-33-37-36-32(38(33)27-13-9-6-10-14-27)26-19-28(40-2)31(42-4)29(20-26)41-3/h5-20H,21H2,1-4H3,(H,35,39)/b34-22+
InChIKey
ORBOIVCIMFBKGV-PPOKSSTKSA-N
Synonyms

(E)N(1((11biphenyl)4yl)ethylidene)2((4phenyl5(345trimethoxyphenyl)4H124triazol3yl)thio)acetohydrazide
CC(=NNC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC(=C(C(=C3)OC)OC)OC)C4=CC=C(C=C4)C5=CC=CC=C5
COc1cc(cc(c1OC)OC)c1nnc(n1c1ccccc1)SCC(=O)NN=C(c1ccc(cc1)c1ccccc1)C
InChI=1SC33H31N5O4Sc122(23151725(181623)24117581224)343530(39)214333373632(38(33)271396101427)261928(402)31(424)29(2026)413h520H21H214H3(H3539)b3422+
MFCD02075173
N((1E)1(BIPHENYL4YL)ETHYLIDENE)2((4PHENYL5(345TRIMETHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETOHYDRAZIDE
N((E)1(4phenylphenyl)ethylideneamino)2((4phenyl5(345trimethoxyphenyl)124triazol3yl)sulfanyl)acetamide
STK090841
ZINC000100318020
ZINC100318024

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Available files

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