ethyl 4-[4-(benzylcarbamoylmethylsulfanyl)-2-oxo-3-(oxolan-2-ylmethyl)-8-sulfanylidene-9-thia-3,5,7-triazabicyclo[4.3.0]nona-4,10-dien-7-yl]benzoate

Molecular Formula: C28H28N4O5S3


InChI: InChI=1/C28H28N4O5S3/c1-2-36-26(35)19-10-12-20(13-11-19)32-24-23(40-28(32)38)25(34)31(16-21-9-6-14-37-21)27(30-24)39-17-22(33)29-15-18-7-4-3-5-8-18/h3-5,7-8,10-13,21H,2,6,9,14-17H2,1H3,(H,29,33)/f/h29H

InChIKey: InChIKey=ANQBKHPEQPWXDA-PKRZOPRNCE
SMILES: CCOC(=O)C1=CC=C(C=C1)N2C3=C(C(=O)N(C(=N3)SCC(=O)NCC4=CC=CC=C4)CC5CCCO5)SC2=S

Names:
    ethyl 4-[4-(benzylcarbamoylmethylsulfanyl)-2-oxo-3-(oxolan-2-ylmethyl)-8-sulfanylidene-9-thia-3,5,7-triazabicyclo[4.3.0]nona-4,10-dien-7-yl]benzoate

Registries:
    PubChem CID 4118293
    PubChem ID 6046561