Vitas-M small molecule compound

N-[(2S)-1-[(furan-2-ylmethyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-4-(1H-indol-3-ylcarbonyl)piperazine-1-carboxamide

Catalog ID
STK621889
SMILES CSCC[C@@H](C(=O)NCc1ccco1)NC(=O)N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2

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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 C24H29N5O4S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N5O4S/c1-34-14-8-21(22(30)26-15-17-5-4-13-33-17)27-24(32)29-11-9-28(10-12-29)23(31)19-16-25-20-7-3-2-6-18(19)20/h2-7,13,16,21,25H,8-12,14-15H2,1H3,(H,26,30)(H,27,32)/t21-/m0/s1
InChIKey
IUSPWARBVVNSAY-NRFANRHFSA-N
Synonyms
1014409-63-2
(S)N(1((furan2ylmethyl)amino)4(methylthio)1oxobutan2yl)4(1Hindole3carbonyl)piperazine1carboxamide
1014409632
CSCC(C@@H)(C(=O)NCc1ccco1)NC(=O)N1CCN(CC1)C(=O)c1c(nH)c2c1cccc2
CSCCC(C(=O)NCC1=CC=CO1)NC(=O)N2CCN(CC2)C(=O)C3=CNC4=CC=CC=C43
InChI=1SC24H29N5O4Sc13414821(22(30)26151754133317)2724(32)2911928(101229)23(31)19162520732618(19)20h2713162125H8121415H21H3(H2630)(H2732)t21m0s1
MFCD09846131
N((2S)1((furan2ylmethyl)amino)4(methylsulfanyl)1oxobutan2yl)4(1Hindol3ylcarbonyl)piperazine1carboxamide
N((2S)1(furan2ylmethylamino)4methylsulfanyl1oxobutan2yl)4(1Hindole3carbonyl)piperazine1carboxamide
ZINC000009547662
ZINC09547662
ZINC9547662

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.