4-[[5-(4-oxo-1-cyclohexa-2,5-dienylidene)-4-(oxolan-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzoic acid
Molecular Formula:
C21H21N3O4S
InChI: InChI=1/C21H21N3O4S/c25-17-9-7-15(8-10-17)19-22-23-21(24(19)12-18-2-1-11-28-18)29-13-14-3-5-16(6-4-14)20(26)27/h3-10,18,22H,1-2,11-13H2,(H,26,27)/f/h26H
InChIKey: InChIKey=KBBPAWAZFNJBQW-HXTKINSTCW
SMILES: C1CC(OC1)CN2C(=C3C=CC(=O)C=C3)NN=C2SCC4=CC=C(C=C4)C(=O)O
Names:
4-[[5-(4-oxo-1-cyclohexa-2,5-dienylidene)-4-(oxolan-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzoic acid
Registries:
PubChem CID 5770699
PubChem ID 4802517
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