Vitas-M small molecule compound
5-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Catalog ID
STK330488
SMILES O=C1CC(C)(C)CC2=C1C(Nc1c2c2ccccc2cc1)c1cn(c2c1cccc2)Cc1ccccc1Cl
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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 C34H29ClN2O MW 517.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H29ClN2O/c1-34(2)17-25-31-23-11-5-3-9-21(23)15-16-28(31)36-33(32(25)30(38)18-34)26-20-37(29-14-8-6-12-24(26)29)19-22-10-4-7-13-27(22)35/h3-16,20,33,36H,17-19H2,1-2H3InChIKey
YLFAPWMCPIATAD-UHFFFAOYSA-NSynonyms
5(1((2chlorophenyl)methyl)indol3yl)22dimethyl1356tetrahydrobenzo(a)phenanthridin4one
5(1(2chlorobenzyl)1Hindol3yl)22dimethyl2356tetrahydrobenzo(a)phenanthridin4(1H)one
CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CN(C6=CC=CC=C65)CC7=CC=CC=C7Cl)C(=O)C1)C
InChI=1SC34H29ClN2Oc134(2)172531231153921(23)151628(31)3633(32(25)30(38)1834)262037(2914861224(26)29)192210471327(22)35h316203336H1719H212H3
MFCD01446556
ZINC000006077138
ZINC000006077212
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