Explore YT-iii-15 | TiHKAL

Exploring YT-iii-15. To explore a different substance…

Name

YT-iii-15

IUPAC name

3-[(8-Chloro-5-methyl-6-oxo-5,6-dihydro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carbonyl)oxy]propyl 8-ethynyl-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate

ID 8251 · Formula C₃₆H₂₇ClN₆O₅ · Molecular weight 659.09

Tags Aryldiazepine

InChI InChI=1S/C36H27ClN6O5/c1-3-22-10-12-27-25(16-22)31(23-8-5-4-6-9-23)38-18-29-32(39-20-42(27)29)35(45)47-14-7-15-48-36(46)33-30-19-41(2)34(44)26-17-24(37)11-13-28(26)43(30)21-40-33/h1,4-6,8-13,16-17,20-21H,7,14-15,18-19H2,2H3

InChI Key HXFMCZHKLQVRHC-UHFFFAOYSA-N This stereoisomer Any stereoisomer

SMILES C#Cc1ccc2c(c1)C(=NCc1n2cnc1C(=O)OCCCOC(=O)c1ncn2c1CN(C)C(=O)c1c2ccc(c1)Cl)c1ccccc1