methyl 4-[2,5-dimethyl-3-[2-[[8-methyl-9-(4-methylphenyl)-2-oxo-3-phenyl-7-thia-3,5-diazabicyclo[4.3.0]nona-4,8,10-trien-4-yl]sulfanyl]acetyl]pyrrol-1-yl]benzoate
Molecular Formula:
C
36
H
31
N
3
O
4
S
2
InChI:
InChI=1/C36H31N3O4S2/c1-21-11-13-25(14-12-21)31-24(4)45-33-32(31)34(41)39(27-9-7-6-8-10-27)36(37-33)44-20-30(40)29-19-22(2)38(23(29)3)28-17-15-26(16-18-28)35(42)43-5/h6-19H,20H2,1-5H3
InChIKey:
InChIKey=HOTBTJAXKZQSGI-UHFFFAOYAY
SMILES:
CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)N(C(=N3)SCC(=O)C4=C(N(C(=C4)C)C5=CC=C(C=C5)C(=O)OC)C)C6=CC=CC=C6)C
Names:
methyl 4-[2,5-dimethyl-3-[2-[[8-methyl-9-(4-methylphenyl)-2-oxo-3-phenyl-7-thia-3,5-diazabicyclo[4.3.0]nona-4,8,10-trien-4-yl]sulfanyl]acetyl]pyrrol-1-yl]benzoate
Registries:
PubChem CID 3538991
PubChem ID 9740888