4-(3,4-dimethylphenyl)-N-[(E)-furan-2-ylmethylideneamino]phthalazin-1-amine

Systemtic Name: 4-(3,4-dimethylphenyl)-N-[(E)-furan-2-ylmethylideneamino]phthalazin-1-amine Openeye Name: 4-(3,4-dimethylphenyl)-N-[(E)-2-furylmethyleneamino]phthalazin-1-amine CAS Name: 4-(3,4-dimethylphenyl)-N-[(E)-2-furanylmethylideneamino]-1-phthalazinamine IUPAC Name: 4-(3,4-dimethylphenyl)-N-[(E)-furan-2-ylmethylideneamino]phthalazin-1-amine Traditional Name: [4-(3,4-dimethylphenyl)phthalazin-1-yl]-[(E)-2-furfurylideneamino]amine Formula: C21H18N4O MolecularWeight: 342.39382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NN=CC4=CC=CO4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)N/N=C/C4=CC=CO4)C

InChI

InChI=1S/C21H18N4O/c1-14-9-10-16(12-15(14)2)20-18-7-3-4-8-19(18)21(25-23-20)24-22-13-17-6-5-11-26-17/h3-13H,1-2H3,(H,24,25)/b22-13+