Vitas-M small molecule compound
N-[3-(1,3-benzodioxol-5-yl)-4-oxo-4H-thiochromen-2-yl]-4-tert-butylbenzamide
Catalog ID
STK715751
SMILES O=C(c1ccc(cc1)C(C)(C)C)Nc1sc2ccccc2c(=O)c1c1ccc2c(c1)OCO2
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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 C27H23NO4S MW 457.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23NO4S/c1-27(2,3)18-11-8-16(9-12-18)25(30)28-26-23(17-10-13-20-21(14-17)32-15-31-20)24(29)19-6-4-5-7-22(19)33-26/h4-14H,15H2,1-3H3,(H,28,30)InChIKey
GIALTWUOZCIGNM-UHFFFAOYSA-NSynonyms
883966-66-3883966663
CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C(=O)C3=CC=CC=C3S2)C4=CC5=C(C=C4)OCO5
InChI=1SC27H23NO4Sc127(23)1811816(91218)25(30)282623(1710132021(1417)32153120)24(29)19645722(19)3326h414H15H213H3(H2830)
MFCD06783693
N(3(13benzodioxol5yl)4oxo4Hthiochromen2yl)4tertbutylbenzamide
N(3(13BENZODIOXOL5YL)4OXOTHIOCHROMEN2YL)4TERTBUTYLBENZAMIDE
N(3(benzo(d)(13)dioxol5yl)4oxo4Hthiochromen2yl)4(tertbutyl)benzamide
ZINC000009328040
ZINC09328040
ZINC9328040
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