Vitas-M small molecule compound
4-{(E)-[2-({[4-(4-chlorophenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2,6-dimethoxyphenyl acetate
Catalog ID
STK106724
SMILES COc1cc(/C=N/NC(=O)CSc2nnc(n2c2ccc(cc2)Cl)c2ccc(cc2)C)cc(c1OC(=O)C)OC
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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 C28H26ClN5O5S MW 580.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26ClN5O5S/c1-17-5-7-20(8-6-17)27-32-33-28(34(27)22-11-9-21(29)10-12-22)40-16-25(36)31-30-15-19-13-23(37-3)26(39-18(2)35)24(14-19)38-4/h5-15H,16H2,1-4H3,(H,31,36)/b30-15+InChIKey
CABQZJJGXPWYRF-FJEPWZHXSA-NSynonyms
(4((E)((2((4(4CHLOROPHENYL)5(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)26DIMETHOXYPHENYL)ACETATE
(E)4((2(2((4(4chlorophenyl)5(ptolyl)4H124triazol3yl)thio)acetyl)hydrazono)methyl)26dimethoxyphenylacetate
4((1E)2(2(4(4CHLOROPHENYL)5(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETYLAMINO)2AZAVINYL)26DIMETHOXYPHENYLACETATE
4((E)(2(((4(4CHLOROPHENYL)5(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)26DIMETHOXYPHENYLACETATE
CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NN=CC4=CC(=C(C(=C4)OC)OC(=O)C)OC
COc1cc(C=NNC(=O)CSc2nnc(n2c2ccc(cc2)Cl)c2ccc(cc2)C)cc(c1OC(=O)C)OC
InChI=1SC28H26ClN5O5Sc1175720(8617)27323328(34(27)2211921(29)101222)401625(36)313015191323(373)26(3918(2)35)24(1419)384h515H16H214H3(H3136)b3015+
MFCD03220208
ZINC000002593247
ZINC101509951
Check stock
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Check stock on Vitas-MAvailable files
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