Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(Z)-(2-chloro-5-nitrophenyl)methylidene]acetohydrazide
Catalog ID
STK104599
SMILES O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C)N/N=C\c1cc(ccc1Cl)[N+](=O)[O-]
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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 C28H27ClN6O3S MW 563.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27ClN6O3S/c1-18-5-11-22(12-6-18)34-26(19-7-9-21(10-8-19)28(2,3)4)32-33-27(34)39-17-25(36)31-30-16-20-15-23(35(37)38)13-14-24(20)29/h5-16H,17H2,1-4H3,(H,31,36)/b30-16-InChIKey
AKGUBDZGYBJIFJ-UHBFCERESA-NSynonyms
(E)2((5(4(tertbutyl)phenyl)4(ptolyl)4H124triazol3yl)thio)N(2chloro5nitrobenzylidene)acetohydrazide
2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N((Z)(2CHLORO5NITROPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N((Z)(2CHLORO5NITROPHENYL)METHYLIDENE)ACETOHYDRAZIDE
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=C(C=CC(=C3)(N+)(=O)(O))Cl)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC28H27ClN6O3Sc11851122(12618)3426(197921(10819)28(23)4)323327(34)391725(36)313016201523(35(37)38)131424(20)29h516H17H214H3(H3136)b3016
MFCD03219877
N((1Z)2(2CHLORO5NITROPHENYL)1AZAVINYL)2(5(4(TERTBUTYL)PHENYL)4(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C)NN=Cc1cc(ccc1Cl)(N+)(=O)(O)
ZINC000097939498
ZINC01901144
ZINC1901144
Check stock
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