benzyl-[3-[[2-[8-[(4-chlorophenyl)methylidene]-9-oxo-7-thia-10-azabicyclo[4.4.0]deca-1,3,5-trien-10-yl]acetyl]amino]propyl]-methyl-azanium
Molecular Formula:
C28H29ClN3O2S+
InChI: InChI=1/C28H28ClN3O2S/c1-31(19-22-8-3-2-4-9-22)17-7-16-30-27(33)20-32-24-10-5-6-11-25(24)35-26(28(32)34)18-21-12-14-23(29)15-13-21/h2-6,8-15,18H,7,16-17,19-20H2,1H3,(H,30,33)/p+1/fC28H29ClN3O2S/h30-31H/q+1
InChIKey: InChIKey=BLAOSVWMWWXTHM-ZHVLJGHPCC
SMILES: C[NH+](CCCNC(=O)CN1C2=CC=CC=C2SC(=CC3=CC=C(C=C3)Cl)C1=O)CC4=CC=CC=C4
Names:
benzyl-[3-[[2-[8-[(4-chlorophenyl)methylidene]-9-oxo-7-thia-10-azabicyclo[4.4.0]deca-1,3,5-trien-10-yl]acetyl]amino]propyl]-methyl-azanium
Registries:
PubChem CID 4130409
PubChem ID 6062936
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