3-(3,4-dimethylphenyl)-1-[1-[5-[(3-methylphenyl)methylsulfanyl]-4-(4-nitrophenyl)-1,2,4-triazol-3-yl]ethyl]urea
Molecular Formula:
C27H28N6O3S
InChI: InChI=1/C27H28N6O3S/c1-17-6-5-7-21(14-17)16-37-27-31-30-25(32(27)23-10-12-24(13-11-23)33(35)36)20(4)28-26(34)29-22-9-8-18(2)19(3)15-22/h5-15,20H,16H2,1-4H3,(H2,28,29,34)/f/h28-29H
InChIKey: InChIKey=LKHNTCBXKOGZSI-LKHHGCNMCM
SMILES: CC1=CC(=CC=C1)CSC2=NN=C(N2C3=CC=C(C=C3)[N+](=O)[O-])C(C)NC(=O)NC4=CC(=C(C=C4)C)C
Names:
3-(3,4-dimethylphenyl)-1-[1-[5-[(3-methylphenyl)methylsulfanyl]-4-(4-nitrophenyl)-1,2,4-triazol-3-yl]ethyl]urea
Registries:
PubChem CID 3544603
PubChem ID 4789540
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