N2-[(E)-(3-phenoxyphenyl)methylideneamino]pyrimidine-2,4,6-triamine

Systemtic Name: N2-[(E)-(3-phenoxyphenyl)methylideneamino]pyrimidine-2,4,6-triamine Openeye Name: N2-[(E)-(3-phenoxyphenyl)methyleneamino]pyrimidine-2,4,6-triamine CAS Name: N2-[(E)-(3-phenoxyphenyl)methylideneamino]pyrimidine-2,4,6-triamine IUPAC Name: 2-N-[(E)-(3-phenoxyphenyl)methylideneamino]pyrimidine-2,4,6-triamine Traditional Name: (4,6-diaminopyrimidin-2-yl)-[(E)-(3-phenoxybenzylidene)amino]amine Formula: C17H16N6O MolecularWeight: 320.34854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)C=NNC3=NC(=CC(=N3)N)N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)/C=N/NC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C17H16N6O/c18-15-10-16(19)22-17(21-15)23-20-11-12-5-4-8-14(9-12)24-13-6-2-1-3-7-13/h1-11H,(H5,18,19,21,22,23)/b20-11+