Vitas-M small molecule compound

N-[(2S)-1-(cyclopropylamino)-4-(methylsulfanyl)-1-oxobutan-2-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Catalog ID
STK614361
SMILES CSCC[C@@H](C(=O)NC1CC1)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccccc1

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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 C20H29N3O4S2 MW 439.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H29N3O4S2/c1-28-14-11-18(20(25)21-16-7-8-16)22-19(24)15-9-12-23(13-10-15)29(26,27)17-5-3-2-4-6-17/h2-6,15-16,18H,7-14H2,1H3,(H,21,25)(H,22,24)/t18-/m0/s1
InChIKey
QKWNQVKCWSOULY-SFHVURJKSA-N
Synonyms
1013751-56-8
(S)N(1(cyclopropylamino)4(methylthio)1oxobutan2yl)1(phenylsulfonyl)piperidine4carboxamide
1(benzenesulfonyl)N((2S)1(cyclopropylamino)4methylsulfanyl1oxobutan2yl)piperidine4carboxamide
1013751568
CSCC(C@@H)(C(=O)NC1CC1)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccccc1
CSCCC(C(=O)NC1CC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3
InChI=1SC20H29N3O4S2c128141118(20(25)21167816)2219(24)1591223(131015)29(2627)175324617h26151618H714H21H3(H2125)(H2224)t18m0s1
MFCD08289101
N((2S)1(cyclopropylamino)4(methylsulfanyl)1oxobutan2yl)1(phenylsulfonyl)piperidine4carboxamide
ZINC000009410134
ZINC09410134
ZINC9410134

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Available files

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