Vitas-M small molecule compound

1-(4-methylphenyl)-5-{[5-(naphthalen-1-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}pent-3-yn-1-one

Catalog ID
STK208693
SMILES Cc1ccc(cc1)C(=O)CC#CCSc1nnc(o1)c1cccc2c1cccc2

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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 C24H18N2O2S MW 398.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N2O2S/c1-17-12-14-19(15-13-17)22(27)11-4-5-16-29-24-26-25-23(28-24)21-10-6-8-18-7-2-3-9-20(18)21/h2-3,6-10,12-15H,11,16H2,1H3
InChIKey
PMNUVEUGCRVBIE-UHFFFAOYSA-N
Synonyms

1(4METHYLPHENYL)5((5(NAPHTHALEN1YL)134OXADIAZOL2YL)SULFANYL)PENT3YN1ONE
1(4METHYLPHENYL)5((5NAPHTHALEN1YL134OXADIAZOL2YL)SULFANYL)PENT3YN1ONE
CC1=CC=C(C=C1)C(=O)CC#CCSC2=NN=C(O2)C3=CC=CC4=CC=CC=C43
InChI=1SC24H18N2O2Sc117121419(151317)22(27)1145162924262523(2824)21106818723920(18)21h236101215H1116H21H3
MFCD06193738
ZINC000004776395
ZINC04776395
ZINC4776395

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Available files

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