4-tert-butyl-N-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl]-N-phenyl-aniline

Systemtic Name: 4-tert-butyl-N-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl]-N-phenyl-aniline Openeye Name: 4-tert-butyl-N-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl]-N-phenyl-aniline CAS Name: 4-tert-butyl-N-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl]-N-phenylaniline IUPAC Name: 4-tert-butyl-N-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl]-N-phenylaniline Traditional Name: (4-tert-butylphenyl)-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl]-phenyl-amine Formula: C27H28ClN3 MolecularWeight: 429.98432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CN(C2=CC=CC=C2)C3=CC=C(C=C3)C(C)(C)C)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1CN(C2=CC=CC=C2)C3=CC=C(C=C3)C(C)(C)C)Cl)C4=CC=CC=C4

InChI

InChI=1S/C27H28ClN3/c1-20-25(26(28)31(29-20)24-13-9-6-10-14-24)19-30(22-11-7-5-8-12-22)23-17-15-21(16-18-23)27(2,3)4/h5-18H,19H2,1-4H3