Vitas-M small molecule compound

4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl 6-{[(4-methylphenyl)sulfonyl]amino}hexanoate

Catalog ID
STK017413
SMILES O=C(Oc1ccc2c(c1)oc(=O)c1c2CCC1)CCCCCNS(=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/c1-17-9-12-19(13-10-17)33(29,30)26-15-4-2-3-8-24(27)31-18-11-14-21-20-6-5-7-22(20)25(28)32-23(21)16-18/h9-14,16,26H,2-8,15H2,1H3
InChIKey
QLIJCAJEHBUQLC-UHFFFAOYSA-N
Synonyms
374702-81-5
(4OXO23DIHYDRO1HCYCLOPENTA(C)CHROMEN7YL)6((4METHYLPHENYL)SULFONYLAMINO)HEXANOATE
374702815
4oxo1234tetrahydrocyclopenta(c)chromen7yl6(((4methylphenyl)sulfonyl)amino)hexanoate
4oxo1234tetrahydrocyclopenta(c)chromen7yl6(4methylphenylsulfonamido)hexanoate
CC1=CC=C(C=C1)S(=O)(=O)NCCCCCC(=O)OC2=CC3=C(C=C2)C4=C(CCC4)C(=O)O3
InChI=1SC25H27NO6Sc11791219(131017)33(2930)2615423824(27)31181114212065722(20)25(28)3223(21)1618h9141626H2815H21H3
MFCD01530194
O=C(Oc1ccc2c(c1)oc(=O)c1c2CCC1)CCCCCNS(=O)(=O)c1ccc(cc1)C
STK017413
ZINC000001829520
ZINC01829520
ZINC1829520

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Available files

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