Vitas-M small molecule compound

2-{[4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3-phenoxyphenyl)methylidene]acetohydrazide

Catalog ID
STK106947
SMILES CCOc1ccc(cc1)n1c(SCC(=O)N/N=C/c2cccc(c2)Oc2ccccc2)nnc1c1ccccc1

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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 C31H27N5O3S MW 549.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27N5O3S/c1-2-38-26-18-16-25(17-19-26)36-30(24-11-5-3-6-12-24)34-35-31(36)40-22-29(37)33-32-21-23-10-9-15-28(20-23)39-27-13-7-4-8-14-27/h3-21H,2,22H2,1H3,(H,33,37)/b32-21+
InChIKey
NHRUADRAPWDECG-RUMWWMSVSA-N
Synonyms
351516-11-5
(E)2((4(4ethoxyphenyl)5phenyl4H124triazol3yl)thio)N(3phenoxybenzylidene)acetohydrazide
2((4(4ETHOXYPHENYL)5PHENYL124TRIAZOL3YL)SULFANYL)N((E)(3PHENOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((4(4ETHOXYPHENYL)5PHENYL4H124TRIAZOL3YL)SULFANYL)N((E)(3PHENOXYPHENYL)METHYLIDENE)ACETOHYDRAZIDE
351516115
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC(=CC=C3)OC4=CC=CC=C4)C5=CC=CC=C5
CCOc1ccc(cc1)n1c(SCC(=O)NN=Cc2cccc(c2)Oc2ccccc2)nnc1c1ccccc1
InChI=1SC31H27N5O3Sc123826181625(171926)3630(24115361224)343531(36)402229(37)333221231091528(2023)3927137481427h321H222H21H3(H3337)b3221+
MFCD01586240
N((1E)2(3PHENOXYPHENYL)1AZAVINYL)2(4(4ETHOXYPHENYL)5PHENYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000001812557
ZINC100242257

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Available files

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