N-[[5-(benzothiazol-2-ylcarbamoylmethylsulfanyl)-4-(2,5-dimethylphenyl)-1,2,4-triazol-3-yl]methyl]-2-methyl-3-nitro-benzamide
Molecular Formula:
C28H25N7O4S2
InChI: InChI=1/C28H25N7O4S2/c1-16-11-12-17(2)22(13-16)34-24(14-29-26(37)19-7-6-9-21(18(19)3)35(38)39)32-33-28(34)40-15-25(36)31-27-30-20-8-4-5-10-23(20)41-27/h4-13H,14-15H2,1-3H3,(H,29,37)(H,30,31,36)/f/h29,31H
InChIKey: InChIKey=XNKDQMODYGPXRF-SCXYCHFOCW
SMILES: CC1=CC(=C(C=C1)C)N2C(=NN=C2SCC(=O)NC3=NC4=CC=CC=C4S3)CNC(=O)C5=C(C(=CC=C5)[N+](=O)[O-])C
Names:
N-[[5-(benzothiazol-2-ylcarbamoylmethylsulfanyl)-4-(2,5-dimethylphenyl)-1,2,4-triazol-3-yl]methyl]-2-methyl-3-nitro-benzamide
Registries:
PubChem CID 4124033
PubChem ID 6054363
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