Vitas-M small molecule compound
3-benzyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl 2-{[(4-methylphenyl)sulfonyl]amino}butanoate
Catalog ID
STL462426
SMILES CCC(C(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1)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 C29H29NO6S MW 519.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29NO6S/c1-5-25(30-37(33,34)22-13-11-18(2)12-14-22)29(32)35-26-16-15-23-19(3)24(17-21-9-7-6-8-10-21)28(31)36-27(23)20(26)4/h6-16,25,30H,5,17H2,1-4H3InChIKey
UCLRAJWSFWSCND-UHFFFAOYSA-NSynonyms
(3BENZYL48DIMETHYL2OXOCHROMEN7YL)2((4METHYLPHENYL)SULFONYLAMINO)BUTANOATE
3benzyl48dimethyl2oxo2Hchromen7yl2(((4methylphenyl)sulfonyl)amino)butanoate
3benzyl48dimethyl2oxo2Hchromen7yl2(4methylphenylsulfonamido)butanoate
CC(C@H)(C(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1)NS(=O)(=O)c1ccc(cc1)C
CCC(C(=O)OC1=C(C2=C(C=C1)C(=C(C(=O)O2)CC3=CC=CC=C3)C)C)NS(=O)(=O)C4=CC=C(C=C4)C
InChI=1SC29H29NO6Sc1525(3037(3334)22131118(2)121422)29(32)352616152319(3)24(172197681021)28(31)3627(23)20(26)4h6162530H517H214H3
MFCD06764253
ZINC000002095720
ZINC000002095722
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