[azanyl-[(4-phenethyloxyphenyl)amino]methylidene]-(4,6-dimethylpyrimidin-2-yl)azanium

Systemtic Name: [azanyl-[(4-phenethyloxyphenyl)amino]methylidene]-(4,6-dimethylpyrimidin-2-yl)azanium Openeye Name: [amino-(4-phenethyloxyanilino)methylene]-(4,6-dimethylpyrimidin-2-yl)ammonium CAS Name: [amino-(4-phenethyloxyanilino)methylidene]-(4,6-dimethyl-2-pyrimidinyl)ammonium IUPAC Name: [amino-(4-phenethyloxyanilino)methylidene]-(4,6-dimethylpyrimidin-2-yl)azanium Traditional Name: [amino-(4-phenethyloxyanilino)methylene]-(4,6-dimethylpyrimidin-2-yl)ammonium Formula: C21H24N5O+ MolecularWeight: 362.44816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)[NH+]=C(N)NC2=CC=C(C=C2)OCCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)[NH+]=C(N)NC2=CC=C(C=C2)OCCC3=CC=CC=C3)C

InChI

InChI=1S/C21H23N5O/c1-15-14-16(2)24-21(23-15)26-20(22)25-18-8-10-19(11-9-18)27-13-12-17-6-4-3-5-7-17/h3-11,14H,12-13H2,1-2H3,(H3,22,23,24,25,26)/p+1