ethyl 4-methyl-8-[(3-nitrophenyl)methylidene]-9-oxo-2-(4-pentoxyphenyl)-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-diene-3-carboxylate
Molecular Formula:
C
28
H
29
N
3
O
6
S
InChI:
InChI=1/C28H29N3O6S/c1-4-6-7-15-37-22-13-11-20(12-14-22)25-24(27(33)36-5-2)18(3)29-28-30(25)26(32)23(38-28)17-19-9-8-10-21(16-19)31(34)35/h8-14,16-17,25H,4-7,15H2,1-3H3
InChIKey:
InChIKey=UQIZSRZUSFKJKK-UHFFFAOYAQ
SMILES:
CCCCCOC1=CC=C(C=C1)C2C(=C(N=C3N2C(=O)C(=CC4=CC(=CC=C4)[N+](=O)[O-])S3)C)C(=O)OCC
Names:
ethyl 4-methyl-8-[(3-nitrophenyl)methylidene]-9-oxo-2-(4-pentoxyphenyl)-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-diene-3-carboxylate
Registries:
PubChem CID 4471114
PubChem ID 6591291