Vitas-M small molecule compound
9-chloro-3a-(4-chlorobenzyl)-2,5-bis(4-methylphenyl)-3a,3b,6a,10b-tetrahydrobenzo[e]pyrrolo[3,4-g]isoindole-1,3,4,6(2H,5H)-tetrone
Catalog ID
STL032348
SMILES Clc1ccc(cc1)CC12C(c3cc(Cl)ccc3C3C1C(=O)N(C3=O)c1ccc(cc1)C)C(=O)N(C2=O)c1ccc(cc1)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 C35H26Cl2N2O4 MW 609.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H26Cl2N2O4/c1-19-3-12-24(13-4-19)38-31(40)28-26-16-11-23(37)17-27(26)29-32(41)39(25-14-5-20(2)6-15-25)34(43)35(29,30(28)33(38)42)18-21-7-9-22(36)10-8-21/h3-17,28-30H,18H2,1-2H3InChIKey
SOMAXJTXTPQWKG-UHFFFAOYSA-NSynonyms
9chloro3a(4chlorobenzyl)25bis(4methylphenyl)3a3b6a10btetrahydrobenzo(e)pyrrolo(34g)isoindole1346(2H5H)tetrone
9chloro3a(4chlorobenzyl)25diptolyl6a10bdihydrobenzo(e)pyrrolo(34g)isoindole1346(2H3aH3bH5H)tetraone
CC1=CC=C(C=C1)N2C(=O)C3C(C2=O)C4(C(C5=C3C=CC(=C5)Cl)C(=O)N(C4=O)C6=CC=C(C=C6)C)CC7=CC=C(C=C7)Cl
InChI=1SC35H26Cl2N2O4c11931224(13419)3831(40)2826161123(37)1727(26)2932(41)39(2514520(2)61525)34(43)35(2930(28)33(38)42)18217922(36)10821h3172830H18H212H3
MFCD04371706
ZINC000102944042
ZINC000226597541
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