Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-N'-[(2E)-4-phenylbutan-2-ylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL003070
SMILES Clc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)N/N=C(/CCc1ccccc1)\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 C22H21ClN8O2S MW 496.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN8O2S/c1-14(7-8-15-5-3-2-4-6-15)25-27-22(32)19-18(13-34-17-11-9-16(23)10-12-17)31(30-26-19)21-20(24)28-33-29-21/h2-6,9-12H,7-8,13H2,1H3,(H2,24,28)(H,27,32)/b25-14+InChIKey
ZLHQHOUKJVVJIG-AFUMVMLFSA-NSynonyms
861640-01-9(E)1(4amino125oxadiazol3yl)5(((4chlorophenyl)thio)methyl)N(4phenylbutan2ylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(((4chlorophenyl)sulfanyl)methyl)N((2E)4phenylbutan2ylidene)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5((4CHLOROPHENYL)SULFANYLMETHYL)N((E)4PHENYLBUTAN2YLIDENEAMINO)TRIAZOLE4CARBOXAMIDE
861640019
CC(=NNC(=O)C1=C(N(N=N1)C2=NON=C2N)CSC3=CC=C(C=C3)Cl)CCC4=CC=CC=C4
Clc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)NN=C(CCc1ccccc1)C
InChI=1SC22H21ClN8O2Sc114(78155324615)252722(32)1918(13341711916(23)101217)31(302619)2120(24)28332921h26912H7813H21H3(H22428)(H2732)b2514+
MFCD05685832
ZINC000013804977
ZINC33657843
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