4-(((4-(10,11-DIHYDRODIBENZO(B,F)THIEPIN-10-YL)-1-PIPERAZINYL)IMINO)ME THYL)-2-ETHOXYPHENOL

CAS No.
86759-00-4
CCD No.
CCD00243889
Formula
C27 H29 N3 O2 S
MolWeight
459.611

Basic Information

Product Name: 4-(((4-(10,11-DIHYDRODIBENZO(B,F)THIEPIN-10-YL)-1-PIPERAZINYL)IMINO)ME THYL)-2-ETHOXYPHENOL
CAS: 86759-00-4
English Synonyms: 4-(((4-(10,11-DIHYDRODIBENZO(B,F)THIEPIN-10-YL)-1-PIPERAZINYL)IMINO)ME THYL)-2-ETHOXYPHENOL
MDL Number.: MFCD01707563
H bond acceptor: 5
H bond donor: 1
Smile: CCOc1cc(ccc1O)/C=N/N2CCN(CC2)C3Cc4ccccc4Sc5c3cccc5
InChi: InChI=1S/C27H29N3O2S/c1-2-32-25-17-20(11-12-24(25)31)19-28-30-15-13-29(14-16-30)23-18-21-7-3-5-9-26(21)33-27-10-6-4-8-22(23)27/h3-12,17,19,23,31H,2,13-16,18H2,1H3/b28-19+
InChiKey: InChIKey=XJRMHNIGFWTHPQ-TURZUDJPSA-N

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