Vitas-M small molecule compound
N-[4-(acetylamino)phenyl]-4-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)cyclohexanecarboxamide
Catalog ID
STK389294
SMILES O=C(C1CCC(CC1)N1C(=O)C2C(C1=O)C1C=CC2C2C1C2)Nc1ccc(cc1)NC(=O)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 C26H29N3O4 MW 447.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O4/c1-13(30)27-15-4-6-16(7-5-15)28-24(31)14-2-8-17(9-3-14)29-25(32)22-18-10-11-19(21-12-20(18)21)23(22)26(29)33/h4-7,10-11,14,17-23H,2-3,8-9,12H2,1H3,(H,27,30)(H,28,31)InChIKey
DWUJVSJNWCYYGP-UHFFFAOYSA-NSynonyms
1024238-44-51024238445
CC(=O)NC1=CC=C(C=C1)NC(=O)C2CCC(CC2)N3C(=O)C4C5C=CC(C4C3=O)C6C5C6
InChI=1SC26H29N3O4c113(30)27154616(7515)2824(31)142817(9314)2925(32)2218101119(211220(18)21)23(22)26(29)33h471011141723H238912H21H3(H2730)(H2831)
MFCD02915637
N(4(ACETYLAMINO)PHENYL)4((3AR4S4AR5AS6R6AS)13DIOXOOCTAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOL2(1H)YL)CYCLOHEXANECARBOXAMIDE
N(4(acetylamino)phenyl)4(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)cyclohexanecarboxamide
N(4acetamidophenyl)4(13dioxo33a44a55a66aoctahydro46ethenocyclopropa(f)isoindol2(1H)yl)cyclohexanecarboxamide
ZINC000195482797
ZINC000239038767
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