Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-1,3-benzodioxol-5-ylmethylidene]-5-{[(4-chlorophenyl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL002094
SMILES Clc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc2c(c1)OCO2
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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 C20H15ClN8O4S MW 498.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClN8O4S/c21-12-2-4-13(5-3-12)34-9-14-17(24-28-29(14)19-18(22)26-33-27-19)20(30)25-23-8-11-1-6-15-16(7-11)32-10-31-15/h1-8H,9-10H2,(H2,22,26)(H,25,30)/b23-8+InChIKey
IZOYFTIHOFHQMO-LIMNOBDPSA-NSynonyms
861631-04-1(E)1(4amino125oxadiazol3yl)N(benzo(d)(13)dioxol5ylmethylene)5(((4chlorophenyl)thio)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)13benzodioxol5ylmethylidene)5(((4chlorophenyl)sulfanyl)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)13benzodioxol5ylmethylideneamino)5((4chlorophenyl)sulfanylmethyl)triazole4carboxamide
861631041
C1OC2=C(O1)C=C(C=C2)C=NNC(=O)C3=C(N(N=N3)C4=NON=C4N)CSC5=CC=C(C=C5)Cl
Clc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)NN=Cc1ccc2c(c1)OCO2
InChI=1SC20H15ClN8O4Sc21122413(5312)3491417(242829(14)1918(22)26332719)20(30)2523811161516(711)32103115h18H910H2(H22226)(H2530)b238+
MFCD05684927
ZINC000009478490
ZINC97494859
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