1-[1-[2,4-bis(chloranyl)-6-methoxy-phenyl]-5-oxidanylidene-4H-pyrazol-3-yl]-3-(4-dodecylphenyl)urea

Systemtic Name: 1-[1-[2,4-bis(chloranyl)-6-methoxy-phenyl]-5-oxidanylidene-4H-pyrazol-3-yl]-3-(4-dodecylphenyl)urea Openeye Name: 1-[1-(2,4-dichloro-6-methoxy-phenyl)-5-oxo-4H-pyrazol-3-yl]-3-(4-dodecylphenyl)urea CAS Name: 1-[1-(2,4-dichloro-6-methoxyphenyl)-5-oxo-4H-pyrazol-3-yl]-3-(4-dodecylphenyl)urea IUPAC Name: 1-[1-(2,4-dichloro-6-methoxyphenyl)-5-oxo-4H-pyrazol-3-yl]-3-(4-dodecylphenyl)urea Traditional Name: 1-[1-(2,4-dichloro-6-methoxy-phenyl)-5-keto-2-pyrazolin-3-yl]-3-(4-laurylphenyl)urea Formula: C29H38Cl2N4O3 MolecularWeight: 561.54302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)NC(=O)NC2=NN(C(=O)C2)C3=C(C=C(C=C3OC)Cl)Cl

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)NC(=O)NC2=NN(C(=O)C2)C3=C(C=C(C=C3OC)Cl)Cl

InChI

InChI=1S/C29H38Cl2N4O3/c1-3-4-5-6-7-8-9-10-11-12-13-21-14-16-23(17-15-21)32-29(37)33-26-20-27(36)35(34-26)28-24(31)18-22(30)19-25(28)38-2/h14-19H,3-13,20H2,1-2H3,(H2,32,33,34,37)