Vitas-M small molecule compound

6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl N-[(4-methylphenyl)sulfonyl]norvalinate

Catalog ID
STL226563
SMILES CCCC(C(=O)Oc1ccc2c(c1)oc(=O)c1c2CCCC1)NS(=O)(=O)c1ccc(cc1)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 C25H27NO6S MW 469.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO6S/c1-3-6-22(26-33(29,30)18-12-9-16(2)10-13-18)25(28)31-17-11-14-20-19-7-4-5-8-21(19)24(27)32-23(20)15-17/h9-15,22,26H,3-8H2,1-2H3
InChIKey
NZMNHNRRSYXINX-UHFFFAOYSA-N
Synonyms

(6oxo78910tetrahydrobenzo(c)chromen3yl)2((4methylphenyl)sulfonylamino)pentanoate
6oxo78910tetrahydro6Hbenzo(c)chromen3yl2(4methylphenylsulfonamido)pentanoate
6oxo78910tetrahydro6Hbenzo(c)chromen3ylN((4methylphenyl)sulfonyl)norvalinate
CCCC(C(=O)OC1=CC2=C(C=C1)C3=C(CCCC3)C(=O)O2)NS(=O)(=O)C4=CC=C(C=C4)C
InChI=1SC25H27NO6Sc13622(2633(2930)1812916(2)101318)25(28)311711142019745821(19)24(27)3223(20)1517h9152226H38H212H3
MFCD04028520
ZINC000002384445
ZINC000002384446

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Available files

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