Vitas-M small molecule compound
10a-[(E)-2-(2-chlorophenyl)ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Catalog ID
STL493478
SMILES O=C1CCN2C(N1)(/C=C/c1ccccc1Cl)C(C)(C)c1c2cccc1
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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 C21H21ClN2O MW 352.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN2O/c1-20(2)16-8-4-6-10-18(16)24-14-12-19(25)23-21(20,24)13-11-15-7-3-5-9-17(15)22/h3-11,13H,12,14H2,1-2H3,(H,23,25)/b13-11+InChIKey
CROLGMNCQXTWCB-ACCUITESSA-NSynonyms
259820-46-7(E)10a(2chlorostyryl)1010dimethyl341010atetrahydropyrimido(12a)indol2(1H)one
10a((E)2(2chlorophenyl)ethenyl)1010dimethyl341010atetrahydropyrimido(12a)indol2(1H)one
10a((E)2(2chlorophenyl)ethenyl)1010dimethyl34dihydro1Hpyrimido(12a)indol2one
259820467
CC1(C2=CC=CC=C2N3C1(NC(=O)CC3)C=CC4=CC=CC=C4Cl)C
InChI=1SC21H21ClN2Oc120(2)168461018(16)24141219(25)2321(2024)131115735917(15)22h31113H1214H212H3(H2325)b1311+
MFCD01460218
O=C1CCN2C(N1)(C=Cc1ccccc1Cl)C(C)(C)c1c2cccc1
ZINC000002424120
ZINC000005218609
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