6-BROMO-1,2-DIHYDRO-2-[[4-(METHYLSULFONYL)PHENYL]METHYL]-1-OXO-4-PHENYL-3-ISOQUINOLINECARBOXYLIC ACID METHYL ESTER

CAS No.
583832-85-3
CCD No.
CCD03976369
Formula
C25 H20 Br N O5 S
MolWeight
526.405

Basic Information

Product Name: 6-BROMO-1,2-DIHYDRO-2-[[4-(METHYLSULFONYL)PHENYL]METHYL]-1-OXO-4-PHENYL-3-ISOQUINOLINECARBOXYLIC ACID METHYL ESTER
CAS: 583832-85-3
English Synonyms: 3-ISOQUINOLINECARBOXYLIC ACID, 6-BROMO-1,2-DIHYDRO-2-[[4-(METHYLSULFONYL)PHENYL]METHYL]-1-OXO-4-PHENYL-, METHYL ESTER ; 6-BROMO-1,2-DIHYDRO-2-[[4-(METHYLSULFONYL)PHENYL]METHYL]-1-OXO-4-PHENYL-3-ISOQUINOLINECARBOXYLIC ACID METHYL ESTER
MDL Number.: MFCD18206798
H bond acceptor: 6
H bond donor: 0
Smile: COC(=O)c1c(c2cc(ccc2c(=O)n1Cc3ccc(cc3)S(=O)(=O)C)Br)c4ccccc4
InChi: InChI=1S/C25H20BrNO5S/c1-32-25(29)23-22(17-6-4-3-5-7-17)21-14-18(26)10-13-20(21)24(28)27(23)15-16-8-11-19(12-9-16)33(2,30)31/h3-14H,15H2,1-2H3
InChiKey: InChIKey=WNTHBRVKPVTIQB-UHFFFAOYSA-N

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