Vitas-M small molecule compound

2-oxo-4-phenyl-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-isoleucinate

Catalog ID
STL461794
SMILES CC[C@H]([C@@H](C(=O)Oc1ccc2c(c1)oc(=O)cc2c1ccccc1)NS(=O)(=O)c1ccc(cc1)C)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 C28H27NO6S MW 505.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27NO6S/c1-4-19(3)27(29-36(32,33)22-13-10-18(2)11-14-22)28(31)34-21-12-15-23-24(20-8-6-5-7-9-20)17-26(30)35-25(23)16-21/h5-17,19,27,29H,4H2,1-3H3/t19-,27+/m1/s1
InChIKey
UXYSPIMGKIZBNS-WINIVTDRSA-N
Synonyms

(2OXO4PHENYLCHROMEN7YL)(2S3R)3METHYL2((4METHYLPHENYL)SULFONYLAMINO)PENTANOATE
(2S3R)2oxo4phenyl2Hchromen7yl3methyl2(4methylphenylsulfonamido)pentanoate
2oxo4phenyl2Hchromen7ylN((4methylphenyl)sulfonyl)Lisoleucinate
CC(C@H)((C@@H)(C(=O)Oc1ccc2c(c1)oc(=O)cc2c1ccccc1)NS(=O)(=O)c1ccc(cc1)C)C
CC(C@H)((C@H)(C(=O)Oc1ccc2c(c1)oc(=O)cc2c1ccccc1)NS(=O)(=O)c1ccc(cc1)C)C
CCC(C)C(C(=O)OC1=CC2=C(C=C1)C(=CC(=O)O2)C3=CC=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)C
InChI=1SC28H27NO6Sc1419(3)27(2936(3233)22131018(2)111422)28(31)342112152324(208657920)1726(30)3525(23)1621h517192729H4H213H3t1927+m1s1
MFCD10041071
ZINC000002095429
ZINC02095429
ZINC2095429

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Available files

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