Vitas-M small molecule compound
1-{[4-(4-methylphenyl)-2-(thiophen-2-yl)-4H-chromen-3-yl]methyl}piperidinium
Catalog ID
STL439780
SMILES Cc1ccc(cc1)C1C(=C(Oc2c1cccc2)c1cccs1)C[NH+]1CCCCC1
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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 C26H28NOS MW 402.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NOS/c1-19-11-13-20(14-12-19)25-21-8-3-4-9-23(21)28-26(24-10-7-17-29-24)22(25)18-27-15-5-2-6-16-27/h3-4,7-14,17,25H,2,5-6,15-16,18H2,1H3/p+1InChIKey
ZRHOORHRLISHGV-UHFFFAOYSA-OSynonyms
1((4(4methylphenyl)2(thiophen2yl)4Hchromen3yl)methyl)piperidinium
1((4(4METHYLPHENYL)2THIOPHEN2YL4HCHROMEN3YL)METHYL)PIPERIDIN1IUM
CC1=CC=C(C=C1)C2C3=CC=CC=C3OC(=C2C(NH+)4CCCCC4)C5=CC=CS5
Cc1ccc(cc1)C1C(=C(Oc2c1cccc2)c1cccs1)C(NH+)1CCCCC1
InChI=1SC26H27NOSc119111320(141219)2521834923(21)2826(24107172924)22(25)1827155261627h347141725H256151618H21H3p+1
ZINC000071405266
ZINC000071405267
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