Vitas-M small molecule compound

5-(benzylsulfanyl)-1-butyl-3,4-dimethyl-1,5-dihydro-2H-pyrrol-2-one

Catalog ID
STK013696
SMILES CCCCN1C(SCc2ccccc2)C(=C(C1=O)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 C17H23NOS MW 289.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23NOS/c1-4-5-11-18-16(19)13(2)14(3)17(18)20-12-15-9-7-6-8-10-15/h6-10,17H,4-5,11-12H2,1-3H3
InChIKey
HOGJFGKCPPCFCN-UHFFFAOYSA-N
Synonyms

2benzylsulfanyl1butyl34dimethyl2Hpyrrol5one
5(BENZYLSULFANYL)1BUTYL34DIMETHYL15DIHYDRO2HPYRROL2ONE
CCCCN1C(C(=C(C1=O)C)C)SCC2=CC=CC=C2
CCCCN1C(SCc2ccccc2)C(=C(C1=O)C)C
InChI=1SC17H23NOSc145111816(19)13(2)14(3)17(18)20121597681015h61017H451112H213H3
MFCD11850937
STK013696
ZINC000008983893
ZINC000008983894

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Available files

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