Vitas-M small molecule compound

2-(1,3-dioxooctahydro-2H-4,7-epoxyisoindol-2-yl)-5-methyl-4-[4-(propan-2-yl)phenyl]thiophene-3-carbonitrile

Catalog ID
STK428801
SMILES N#Cc1c(c2ccc(cc2)C(C)C)c(sc1N1C(=O)C2C(C1=O)C1OC2CC1)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 C23H22N2O3S MW 406.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O3S/c1-11(2)13-4-6-14(7-5-13)18-12(3)29-23(15(18)10-24)25-21(26)19-16-8-9-17(28-16)20(19)22(25)27/h4-7,11,16-17,19-20H,8-9H2,1-3H3
InChIKey
HVCSFLDSJWXOSE-UHFFFAOYSA-N
Synonyms

2(13dioxo3a45677ahexahydrooctahydro1H47epoxyisoindol2yl)5methyl4(4propan2ylphenyl)thiophene3carbonitrile
2(13DIOXOOCTAHYDRO2H47EPOXYISOINDOL2YL)5METHYL4(4(1METHYLETHYL)PHENYL)THIOPHENE3CARBONITRILE
2(13dioxooctahydro2H47epoxyisoindol2yl)5methyl4(4(propan2yl)phenyl)thiophene3carbonitrile
CC1=C(C(=C(S1)N2C(=O)C3C4CCC(C3C2=O)O4)C#N)C5=CC=C(C=C5)C(C)C
InChI=1SC23H22N2O3Sc111(2)134614(7513)1812(3)2923(15(18)1024)2521(26)19168917(2816)20(19)22(25)27h471116171920H89H213H3
MFCD03233423
ZINC000102632130
ZINC000102632136

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Available files

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