Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-cyclohex-3-en-1-ylmethylidene]-5-{[(4-methylphenyl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL347130
SMILES Cc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)N/N=C/C1CCC=CC1
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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 C20H22N8O2S MW 438.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N8O2S/c1-13-7-9-15(10-8-13)31-12-16-17(23-27-28(16)19-18(21)25-30-26-19)20(29)24-22-11-14-5-3-2-4-6-14/h2-3,7-11,14H,4-6,12H2,1H3,(H2,21,25)(H,24,29)/b22-11+InChIKey
YTPILWYEXPDZFM-SSDVNMTOSA-NSynonyms
849018-27-5(E)1(4amino125oxadiazol3yl)N(cyclohex3en1ylmethylene)5((ptolylthio)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)cyclohex3en1ylmethylidene)5(((4methylphenyl)sulfanyl)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)cyclohex3en1ylmethylideneamino)5((4methylphenyl)sulfanylmethyl)triazole4carboxamide
1(4AMINOFURAZAN3YL)5PTOLYLSULFANYLMETHYL1H(123)TRIAZOLE4CARBOXYLICACID(1CYCLOHEX3ENYLMETH(E)YLIDENE)HYDRAZIDE
849018275
CC1=CC=C(C=C1)SCC2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4CCC=CC4
Cc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)NN=CC1CCC=CC1
InChI=1SC20H22N8O2Sc1137915(10813)31121617(232728(16)1918(21)25302619)20(29)242211145324614h2371114H4612H21H3(H22125)(H2429)b2211+
MFCD05680908
ZINC000013143949
ZINC000013143953
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