N3-(2,6-dimethylphenyl)-1-(3-methoxy-3-methyl-butyl)-N6-phenyl-indazole-3,6-diamine

Systemtic Name: N3-(2,6-dimethylphenyl)-1-(3-methoxy-3-methyl-butyl)-N6-phenyl-indazole-3,6-diamine Openeye Name: N3-(2,6-dimethylphenyl)-1-(3-methoxy-3-methyl-butyl)-N6-phenyl-indazole-3,6-diamine CAS Name: N3-(2,6-dimethylphenyl)-1-(3-methoxy-3-methylbutyl)-N6-phenylindazole-3,6-diamine IUPAC Name: 3-N-(2,6-dimethylphenyl)-1-(3-methoxy-3-methylbutyl)-6-N-phenylindazole-3,6-diamine Traditional Name: [6-anilino-1-(3-methoxy-3-methyl-butyl)indazol-3-yl]-(2,6-dimethylphenyl)amine Formula: C27H32N4O MolecularWeight: 428.56918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC2=NN(C3=C2C=CC(=C3)NC4=CC=CC=C4)CCC(C)(C)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC2=NN(C3=C2C=CC(=C3)NC4=CC=CC=C4)CCC(C)(C)OC

InChI

InChI=1S/C27H32N4O/c1-19-10-9-11-20(2)25(19)29-26-23-15-14-22(28-21-12-7-6-8-13-21)18-24(23)31(30-26)17-16-27(3,4)32-5/h6-15,18,28H,16-17H2,1-5H3,(H,29,30)