Vitas-M small molecule compound

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

Catalog ID
STK107494
SMILES CCOc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(c(c2)OC)OC)nnc1c1ccc(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 C27H26ClN5O4S MW 552.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN5O4S/c1-4-37-22-12-10-21(11-13-22)33-26(19-6-8-20(28)9-7-19)31-32-27(33)38-17-25(34)30-29-16-18-5-14-23(35-2)24(15-18)36-3/h5-16H,4,17H2,1-3H3,(H,30,34)/b29-16+
InChIKey
AYYZSUPSSQABFN-MUFRIFMGSA-N
Synonyms

(E)2((5(4chlorophenyl)4(4ethoxyphenyl)4H124triazol3yl)thio)N(34dimethoxybenzylidene)acetohydrazide
2((5(4CHLOROPHENYL)4(4ETHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(34DIMETHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(4CHLOROPHENYL)4(4ETHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N((E)(34DIMETHOXYPHENYL)METHYLIDENE)ACETOHYDRAZIDE
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC(=C(C=C3)OC)OC)C4=CC=C(C=C4)Cl
CCOc1ccc(cc1)n1c(SCC(=O)NN=Cc2ccc(c(c2)OC)OC)nnc1c1ccc(cc1)Cl
InChI=1SC27H26ClN5O4Sc143722121021(111322)3326(196820(28)9719)313227(33)381725(34)3029161851423(352)24(1518)363h516H417H213H3(H3034)b2916+
MFCD01586321
N((1E)2(34DIMETHOXYPHENYL)1AZAVINYL)2(5(4CHLOROPHENYL)4(4ETHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002589945
ZINC100242238

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Available files

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