8λ4-thia-7,9-diazabicyclo[4.3.0]nona-2,4,7,8,10-pentaen-2-ylcarbamoylmethyl 2-[(3-methylbenzoyl)amino]-4-methylsulfanyl-butanoate

Molecular Formula: C21H22N4O4S2


InChI: InChI=1/C21H22N4O4S2/c1-13-5-3-6-14(11-13)20(27)23-17(9-10-30-2)21(28)29-12-18(26)22-15-7-4-8-16-19(15)25-31-24-16/h3-8,11,17H,9-10,12H2,1-2H3,(H,22,26)(H,23,27)/f/h22-23H

InChIKey: InChIKey=VWHUPYTZJDRXST-PDJAEHLQCS
SMILES: CC1=CC=CC(=C1)C(=O)NC(CCSC)C(=O)OCC(=O)NC2=CC=CC3=C2N=S=N3

Names:
    8λ4-thia-7,9-diazabicyclo[4.3.0]nona-2,4,7,8,10-pentaen-2-ylcarbamoylmethyl 2-[(3-methylbenzoyl)amino]-4-methylsulfanyl-butanoate

Registries:
    PubChem CID 4833260
    PubChem ID 9795784