Vitas-M small molecule compound

(5Z)-2-(4-benzylpiperidin-1-yl)-5-(4-chlorobenzylidene)-1,3-thiazol-4(5H)-one

Catalog ID
STK012292
SMILES Clc1ccc(cc1)/C=C/1\SC(=NC1=O)N1CCC(CC1)Cc1ccccc1

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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 C22H21ClN2OS MW 396.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN2OS/c23-19-8-6-17(7-9-19)15-20-21(26)24-22(27-20)25-12-10-18(11-13-25)14-16-4-2-1-3-5-16/h1-9,15,18H,10-14H2/b20-15-
InChIKey
KXSARXUCUHIRCA-HKWRFOASSA-N
Synonyms

(5Z)2(4BENZYLPIPERIDIN1YL)5((4CHLOROPHENYL)METHYLIDENE)13THIAZOL4ONE
(5Z)2(4BENZYLPIPERIDIN1YL)5(4CHLOROBENZYLIDENE)13THIAZOL4(5H)ONE
C1CN(CCC1CC2=CC=CC=C2)C3=NC(=O)C(=CC4=CC=C(C=C4)Cl)S3
Clc1ccc(cc1)C=C1SC(=NC1=O)N1CCC(CC1)Cc1ccccc1
InChI=1SC22H21ClN2OSc23198617(7919)152021(26)2422(2720)25121018(111325)14164213516h191518H1014H2b2015
MFCD02982432
STK012292
ZINC000004551493
ZINC04551493
ZINC4551493

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Available files

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