Vitas-M small molecule compound

2-({(E)-[1-(4-methylbenzyl)-1H-indol-3-yl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione

Catalog ID
STK279159
SMILES Cc1ccc(cc1)Cn1cc(c2c1cccc2)/C=N/N1C(=O)C2C(C1=O)C1CCC2C=C1

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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 C27H25N3O2 MW 423.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O2/c1-17-6-8-18(9-7-17)15-29-16-21(22-4-2-3-5-23(22)29)14-28-30-26(31)24-19-10-11-20(13-12-19)25(24)27(30)32/h2-11,14,16,19-20,24-25H,12-13,15H2,1H3/b28-14+
InChIKey
GEYKRQBKMMVXTK-CCVNUDIWSA-N
Synonyms

2(((E)(1(4METHYLBENZYL)1HINDOL3YL)METHYLIDENE)AMINO)3A477ATETRAHYDRO1H47ETHANOISOINDOLE13(2H)DIONE
CC1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C=NN4C(=O)C5C6CCC(C5C4=O)C=C6
Cc1ccc(cc1)Cn1cc(c2c1cccc2)C=NN1C(=O)C2C(C1=O)C1CCC2C=C1
InChI=1SC27H25N3O2c1176818(9717)15291621(22423523(22)29)14283026(31)2419101120(131219)25(24)27(30)32h211141619202425H121315H21H3b2814+
MFCD09269724
ZINC000101026979
ZINC000107902980

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Available files

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