Vitas-M small molecule compound
3-benzyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-phenylalaninate
Catalog ID
STL462430
SMILES O=C([C@@H](NS(=O)(=O)c1ccc(cc1)C)Cc1ccccc1)Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1
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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 C34H31NO6S MW 581.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H31NO6S/c1-22-14-16-27(17-15-22)42(38,39)35-30(21-26-12-8-5-9-13-26)34(37)40-31-19-18-28-23(2)29(20-25-10-6-4-7-11-25)33(36)41-32(28)24(31)3/h4-19,30,35H,20-21H2,1-3H3/t30-/m0/s1InChIKey
IPSCHPPRKWYJMT-PMERELPUSA-NSynonyms
(3BENZYL48DIMETHYL2OXOCHROMEN7YL)(2S)2((4METHYLPHENYL)SULFONYLAMINO)3PHENYLPROPANOATE
(S)3benzyl48dimethyl2oxo2Hchromen7yl2(4methylphenylsulfonamido)3phenylpropanoate
3benzyl48dimethyl2oxo2Hchromen7ylN((4methylphenyl)sulfonyl)Lphenylalaninate
CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)OC3=C(C4=C(C=C3)C(=C(C(=O)O4)CC5=CC=CC=C5)C)C
InChI=1SC34H31NO6Sc122141627(171522)42(3839)3530(2126128591326)34(37)403119182823(2)29(2025106471125)33(36)4132(28)24(31)3h4193035H2021H213H3t30m0s1
MFCD05726613
O=C((C@@H)(NS(=O)(=O)c1ccc(cc1)C)Cc1ccccc1)Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1
O=C((C@H)(NS(=O)(=O)c1ccc(cc1)C)Cc1ccccc1)Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1
ZINC000001901456
ZINC01901456
ZINC1901456
Check stock
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Check stock on Vitas-MAvailable files
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