benzyl 4-methyl-8-[(3-nitrophenyl)methylidene]-9-oxo-2-(4-propoxyphenyl)-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-diene-3-carboxylate
Molecular Formula:
C
31
H
27
N
3
O
6
S
InChI:
InChI=1/C31H27N3O6S/c1-3-16-39-25-14-12-23(13-15-25)28-27(30(36)40-19-21-8-5-4-6-9-21)20(2)32-31-33(28)29(35)26(41-31)18-22-10-7-11-24(17-22)34(37)38/h4-15,17-18,28H,3,16,19H2,1-2H3
InChIKey:
InChIKey=MQDUWMOOPDUJHK-UHFFFAOYAY
SMILES:
CCCOC1=CC=C(C=C1)C2C(=C(N=C3N2C(=O)C(=CC4=CC(=CC=C4)[N+](=O)[O-])S3)C)C(=O)OCC5=CC=CC=C5
Names:
benzyl 4-methyl-8-[(3-nitrophenyl)methylidene]-9-oxo-2-(4-propoxyphenyl)-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-diene-3-carboxylate
Registries:
PubChem CID 4470904
PubChem ID 6591048