Vitas-M small molecule compound
2-[2-(2-methylphenyl)-4,6-dioxo-3-(thiophen-2-yl)hexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Catalog ID
STL020362
SMILES N#Cc1c(sc2c1CCCC2)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1C)c1cccs1
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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 C25H21N3O3S2 MW 475.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O3S2/c1-14-7-2-4-9-17(14)28-21(19-11-6-12-32-19)20-22(31-28)24(30)27(23(20)29)25-16(13-26)15-8-3-5-10-18(15)33-25/h2,4,6-7,9,11-12,20-22H,3,5,8,10H2,1H3InChIKey
ODKVWSKHQDRQMD-UHFFFAOYSA-NSynonyms
1212321-39-51212321395
2(2(2methylphenyl)46dioxo3(thiophen2yl)hexahydro5Hpyrrolo(34d)(12)oxazol5yl)4567tetrahydro1benzothiophene3carbonitrile
2(2(2methylphenyl)46dioxo3thiophen2yl3a6adihydro3Hpyrrolo(34d)(12)oxazol5yl)4567tetrahydro1benzothiophene3carbonitrile
CC1=CC=CC=C1N2C(C3C(O2)C(=O)N(C3=O)C4=C(C5=C(S4)CCCC5)C#N)C6=CC=CS6
InChI=1SC25H21N3O3S2c114724917(14)2821(19116123219)2022(3128)24(30)27(23(20)29)2516(1326)158351018(15)3325h2467911122022H35810H21H3
MFCD02971216
ZINC000102863265
ZINC000245238434
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