Vitas-M small molecule compound

N-[1-(4-ethyl-5-{[2-(4-methylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-2-methylpropyl]-4-methylbenzamide

Catalog ID
STL384123
SMILES CCn1c(SCC(=O)N2CCN(CC2)C)nnc1C(C(C)C)NC(=O)c1ccc(cc1)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 C23H34N6O2S MW 458.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H34N6O2S/c1-6-29-21(20(16(2)3)24-22(31)18-9-7-17(4)8-10-18)25-26-23(29)32-15-19(30)28-13-11-27(5)12-14-28/h7-10,16,20H,6,11-15H2,1-5H3,(H,24,31)
InChIKey
KWOORDSBFGFXHU-UHFFFAOYSA-N
Synonyms

CCN1C(=NN=C1SCC(=O)N2CCN(CC2)C)C(C(C)C)NC(=O)C3=CC=C(C=C3)C
InChI=1SC23H34N6O2Sc162921(20(16(2)3)2422(31)189717(4)81018)252623(29)321519(30)28131127(5)121428h7101620H61115H215H3(H2431)
MFCD06124806
N(1(4ethyl5((2(4methylpiperazin1yl)2oxoethyl)sulfanyl)4H124triazol3yl)2methylpropyl)4methylbenzamide
N(1(4ETHYL5(2(4METHYLPIPERAZIN1YL)2OXOETHYL)SULFANYL124TRIAZOL3YL)2METHYLPROPYL)4METHYLBENZAMIDE
N(1(4ETHYL5(2(4METHYLPIPERAZIN1YL)2OXOETHYLTHIO)4H124TRIAZOL3YL)2METHYLPROPYL)4METHYLBENZAMIDE
ZINC000025180766
ZINC000025180774

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Available files

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