2-chloro-4-[5-[(Z)-[3-ethoxycarbonyl-4-methyl-2-(4-methylphenyl)-9-oxo-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-dien-8-ylidene]methyl]-2-furyl]benzoic acid
Molecular Formula:
C
29
H
23
ClN
2
O
6
S
InChI:
InChI=1/C29H23ClN2O6S/c1-4-37-28(36)24-16(3)31-29-32(25(24)17-7-5-15(2)6-8-17)26(33)23(39-29)14-19-10-12-22(38-19)18-9-11-20(27(34)35)21(30)13-18/h5-14,25H,4H2,1-3H3,(H,34,35)/b23-14-/f/h34H
InChIKey:
InChIKey=KJEMOLBKWYMQOM-PDVYLHFJDO
SMILES:
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C)C(=O)C(=CC4=CC=C(O4)C5=CC(=C(C=C5)C(=O)O)Cl)S2)C
Names:
2-chloro-4-[5-[(Z)-[3-ethoxycarbonyl-4-methyl-2-(4-methylphenyl)-9-oxo-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-dien-8-ylidene]methyl]-2-furyl]benzoic acid
Registries:
PubChem CID 5344599
PubChem ID 11576056