Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL346768
SMILES O=C(c1nnn(c1CSc1nncn1C)c1nonc1N)N/N=C/c1ccc(cc1)N(C)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 C18H20N12O2S MW 468.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N12O2S/c1-28(2)12-6-4-11(5-7-12)8-20-23-17(31)14-13(9-33-18-24-21-10-29(18)3)30(27-22-14)16-15(19)25-32-26-16/h4-8,10H,9H2,1-3H3,(H2,19,25)(H,23,31)/b20-8+InChIKey
NYDBDLXMAZBIRE-DNTJNYDQSA-NSynonyms
848993-22-6(E)1(4amino125oxadiazol3yl)N(4(dimethylamino)benzylidene)5(((4methyl4H124triazol3yl)thio)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(4(dimethylamino)phenyl)methylidene)5(((4methyl4H124triazol3yl)sulfanyl)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(4(dimethylamino)phenyl)methylideneamino)5((4methyl124triazol3yl)sulfanylmethyl)triazole4carboxamide
848993226
CN1C=NN=C1SCC2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC=C(C=C4)N(C)C
InChI=1SC18H20N12O2Sc128(2)126411(5712)8202317(31)1413(9331824211029(18)3)30(272214)1615(19)25322616h4810H9H213H3(H21925)(H2331)b208+
MFCD05679175
O=C(c1nnn(c1CSc1nncn1C)c1nonc1N)NN=Cc1ccc(cc1)N(C)C
ZINC000002447121
ZINC33372681
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