Vitas-M small molecule compound

ethyl 1-[(4-{[(4-chlorophenyl)sulfanyl]methyl}phenyl)carbonyl]piperidine-4-carboxylate

Catalog ID
STK076551
SMILES CCOC(=O)C1CCN(CC1)C(=O)c1ccc(cc1)CSc1ccc(cc1)Cl

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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 C22H24ClNO3S MW 417.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClNO3S/c1-2-27-22(26)18-11-13-24(14-12-18)21(25)17-5-3-16(4-6-17)15-28-20-9-7-19(23)8-10-20/h3-10,18H,2,11-15H2,1H3
InChIKey
BHGVEIUTEXVTKL-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1CCN(CC1)C(=O)c1ccc(cc1)CSc1ccc(cc1)Cl
CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl
ETHYL1((4(((4CHLOROPHENYL)SULFANYL)METHYL)PHENYL)CARBONYL)PIPERIDINE4CARBOXYLATE
ETHYL1(4((4CHLOROPHENYL)SULFANYLMETHYL)BENZOYL)PIPERIDINE4CARBOXYLATE
InChI=1SC22H24ClNO3Sc122722(26)18111324(141218)21(25)175316(4617)1528209719(23)81020h31018H21115H21H3
MFCD03555935
STK076551
ZINC000004600487
ZINC04600487
ZINC4600487

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Available files

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