Vitas-M small molecule compound
4-(7,7-dimethyl-9,11-dioxo-6,7,8,9,10,11-hexahydro-5H-indeno[1,2-b]quinolin-10-yl)phenyl 10H-phenothiazine-10-carboxylate
Catalog ID
STK132391
SMILES O=C1CC(C)(C)CC2=C1C(c1ccc(cc1)OC(=O)N1c3ccccc3Sc3c1cccc3)C1=C(N2)c2c(C1=O)cccc2
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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 C37H28N2O4S MW 596.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H28N2O4S/c1-37(2)19-25-32(28(40)20-37)31(33-34(38-25)23-9-3-4-10-24(23)35(33)41)21-15-17-22(18-16-21)43-36(42)39-26-11-5-7-13-29(26)44-30-14-8-6-12-27(30)39/h3-18,31,38H,19-20H2,1-2H3InChIKey
YCGGLFNWRQRLQW-UHFFFAOYSA-NSynonyms
(4(77dimethyl911dioxo56810tetrahydroindeno(12b)quinolin10yl)phenyl)phenothiazine10carboxylate
4(77dimethyl911dioxo67891011hexahydro5Hindeno(12b)quinolin10yl)phenyl10Hphenothiazine10carboxylate
CC1(CC2=C(C(C3=C(N2)C4=CC=CC=C4C3=O)C5=CC=C(C=C5)OC(=O)N6C7=CC=CC=C7SC8=CC=CC=C86)C(=O)C1)C
InChI=1SC37H28N2O4Sc137(2)192532(28(40)2037)31(3334(3825)239341024(23)35(33)41)21151722(181621)4336(42)392611571329(26)443014861227(30)39h3183138H1920H212H3
MFCD03007900
ZINC000100416252
ZINC000100416257
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