Vitas-M small molecule compound
N-{4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methylphenyl)sulfanyl]methyl}-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenyl}acetamide
Catalog ID
STL004353
SMILES CC(=O)Nc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CSc1ccc(cc1)C)c1nonc1N
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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 C22H21N9O3S MW 491.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N9O3S/c1-13-3-9-17(10-4-13)35-12-18-19(26-30-31(18)21-20(23)28-34-29-21)22(33)27-24-11-15-5-7-16(8-6-15)25-14(2)32/h3-11H,12H2,1-2H3,(H2,23,28)(H,25,32)(H,27,33)/b24-11+InChIKey
XYRHKCARCXKVAA-BHGWPJFGSA-NSynonyms
862106-22-7(E)N(4((2(1(4amino125oxadiazol3yl)5((ptolylthio)methyl)1H123triazole4carbonyl)hydrazono)methyl)phenyl)acetamide
862106227
CC(=O)Nc1ccc(cc1)C=NNC(=O)c1nnn(c1CSc1ccc(cc1)C)c1nonc1N
CC1=CC=C(C=C1)SCC2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC=C(C=C4)NC(=O)C
InChI=1SC22H21N9O3Sc1133917(10413)35121819(263031(18)2120(23)28342921)22(33)272411155716(8615)2514(2)32h311H12H212H3(H22328)(H2532)(H2733)b2411+
MFCD05686854
N((E)(4acetamidophenyl)methylideneamino)1(4amino125oxadiazol3yl)5((4methylphenyl)sulfanylmethyl)triazole4carboxamide
N(4((E)(2((1(4amino125oxadiazol3yl)5(((4methylphenyl)sulfanyl)methyl)1H123triazol4yl)carbonyl)hydrazinylidene)methyl)phenyl)acetamide
ZINC000009498019
ZINC33380232
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