Vitas-M small molecule compound

2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1Z)-1-(4-nitrophenyl)ethylidene]acetohydrazide

Catalog ID
STK101004
SMILES CCn1c(SCC(=O)N/N=C(\c2ccc(cc2)[N+](=O)[O-])/C)nnc1c1ccc(cc1)C(C)(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 C24H28N6O3S MW 480.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N6O3S/c1-6-29-22(18-7-11-19(12-8-18)24(3,4)5)27-28-23(29)34-15-21(31)26-25-16(2)17-9-13-20(14-10-17)30(32)33/h7-14H,6,15H2,1-5H3,(H,26,31)/b25-16-
InChIKey
NUFMHIXPMSVLSL-XYGWBWBKSA-N
Synonyms

2((5(4TERTBUTYLPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)N((Z)1(4NITROPHENYL)ETHYLIDENEAMINO)ACETAMIDE
2((5(4TERTBUTYLPHENYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)N((1Z)1(4NITROPHENYL)ETHYLIDENE)ACETOHYDRAZIDE
CCN1C(=NN=C1SCC(=O)NN=C(C)C2=CC=C(C=C2)(N+)(=O)(O))C3=CC=C(C=C3)C(C)(C)C
CCn1c(SCC(=O)NN=C(c2ccc(cc2)(N+)(=O)(O))C)nnc1c1ccc(cc1)C(C)(C)C
InChI=1SC24H28N6O3Sc162922(1871119(12818)24(34)5)272823(29)341521(31)262516(2)1791320(141017)30(32)33h714H615H215H3(H2631)b2516
MFCD03219112
N((1Z)2(4NITROPHENYL)1AZAPROP1ENYL)2(5(4(TERTBUTYL)PHENYL)4ETHYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000009762360
ZINC35224102

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Available files

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